6-methyl-N-[1-[[5-[4-(oxan-4-ylmethyl)piperazin-1-yl]-5-oxidanylidene-1-phenyl-pentan-2-yl]carbamoyl]cyclopentyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 6-methyl-N-[1-[[5-[4-(oxan-4-ylmethyl)piperazin-1-yl]-5-oxidanylidene-1-phenyl-pentan-2-yl]carbamoyl]cyclopentyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[1-[[1-benzyl-4-oxo-4-[4-(tetrahydropyran-4-ylmethyl)piperazin-1-yl]butyl]carbamoyl]cyclopentyl]-6-methyl-benzothiophene-2-carboxamide CAS Name: 6-methyl-N-[1-[[[5-[4-(4-oxanylmethyl)-1-piperazinyl]-5-oxo-1-phenylpentan-2-yl]amino]-oxomethyl]cyclopentyl]-1-benzothiophene-2-carboxamide IUPAC Name: 6-methyl-N-[1-[[5-[4-(oxan-4-ylmethyl)piperazin-1-yl]-5-oxo-1-phenylpentan-2-yl]carbamoyl]cyclopentyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[1-[[1-benzyl-4-keto-4-[4-(tetrahydropyran-4-ylmethyl)piperazino]butyl]carbamoyl]cyclopentyl]-6-methyl-benzothiophene-2-carboxamide Formula: C37H48N4O4S MolecularWeight: 644.86642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(S2)C(=O)NC3(CCCC3)C(=O)NC(CCC(=O)N4CCN(CC4)CC5CCOCC5)CC6=CC=CC=C6

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(S2)C(=O)NC3(CCCC3)C(=O)NC(CCC(=O)N4CCN(CC4)CC5CCOCC5)CC6=CC=CC=C6

InChI

InChI=1S/C37H48N4O4S/c1-27-9-10-30-25-33(46-32(30)23-27)35(43)39-37(15-5-6-16-37)36(44)38-31(24-28-7-3-2-4-8-28)11-12-34(42)41-19-17-40(18-20-41)26-29-13-21-45-22-14-29/h2-4,7-10,23,25,29,31H,5-6,11-22,24,26H2,1H3,(H,38,44)(H,39,43)