[2-(cyclopropylmethyl)-7-methyl-6,8-bis(oxidanylidene)-3-thiophen-3-yl-isoquinolin-7-yl] cyclopentanecarboxylate

Systemtic Name: [2-(cyclopropylmethyl)-7-methyl-6,8-bis(oxidanylidene)-3-thiophen-3-yl-isoquinolin-7-yl] cyclopentanecarboxylate Openeye Name: [2-(cyclopropylmethyl)-7-methyl-6,8-dioxo-3-(3-thienyl)-7-isoquinolyl] cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic acid [2-(cyclopropylmethyl)-7-methyl-6,8-dioxo-3-(3-thiophenyl)-7-isoquinolinyl] ester IUPAC Name: [2-(cyclopropylmethyl)-7-methyl-6,8-dioxo-3-thiophen-3-ylisoquinolin-7-yl] cyclopentanecarboxylate Traditional Name: cyclopentanecarboxylic acid [2-(cyclopropylmethyl)-6,8-diketo-7-methyl-3-(3-thienyl)-7-isoquinolyl] ester Formula: C24H25NO4S MolecularWeight: 423.5246

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C=C2C=C(N(C=C2C1=O)CC3CC3)C4=CSC=C4)OC(=O)C5CCCC5

Isomeric SMILES

CC1(C(=O)C=C2C=C(N(C=C2C1=O)CC3CC3)C4=CSC=C4)OC(=O)C5CCCC5

InChI

InChI=1S/C24H25NO4S/c1-24(29-23(28)16-4-2-3-5-16)21(26)11-18-10-20(17-8-9-30-14-17)25(12-15-6-7-15)13-19(18)22(24)27/h8-11,13-16H,2-7,12H2,1H3