이름: N-[17-[5-(4-methyl-3-pyridyl)-6-methoxyisoquinolin-1-yloxy]-13-methyl-2,14-dioxo-3,13,15-triaza-tricyclo[13.3.0.04,6]octadec-7-ene-4-carbonyl](cyclopropyl)sulfonamide
IUPAC: N-cyclopropylsulfonyl-17-[6-methoxy-5-(4-methyl-3-pyridinyl)isoquinolin-1-yl]oxy-13-methyl-2,14-dioxo-3,13,15-triazatricyclo[13.3.0.04,6]octadec-7-ene-4-carboxamide
SMILES:
COc1ccc2c(OC3CC4C(=O)NC5(C(=O)NS(=O)(=O)C6CC6)CC5C=CCCCCN(C)C(=O)N4C3)nccc2c1-c1cnccc1CCanonical SMILES:
CC1=C(C=NC=C1)C2=C(C=CC3=C2C=CN=C3OC4CC5C(=O)NC6(CC6C=CCCCCN(C(=O)N5C4)C)C(=O)NS(=O)(=O)C7CC7)OC분자식: C36H42N6O7S
분자량: 702.80
InChIKey: RUPJXOZXFXFMQM-UHFFFAOYSA-N
InChI:
PubChem CID: 67387922 →InChI=1S/C36H42N6O7S/c1-22-13-15-37-20-28(22)31-26-14-16-38-33(27(26)11-12-30(31)48-3)49-24-18-29-32(43)39-36(34(44)40-50(46,47)25-9-10-25)19-23(36)8-6-4-5-7-17-41(2)35(45)42(29)21-24/h6,8,11-16,20,23-25,29H,4-5,7,9-10,17-19,21H2,1-3H3,(H,39,43)(H,40,44)동의어
SCHEMBL2384442RUPJXOZXFXFMQM-UHFFFAOYSA-NN-[17-[5-(4-methyl-3-pyridyl)-6-methoxyisoquinolin-1-yloxy]-13-methyl-2,14-dioxo-3,13,15-triaza-tricyclo[13.3.0.04,6]octadec-7-ene-4-carbonyl](cyclopropyl)sulfonamide
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