N,2-dicyclohexyl-2-[[2-(6-methoxy-1-benzothiophen-3-yl)-2-oxidanylidene-ethanoyl]-(2-piperazin-1-ylethyl)amino]ethanamide

Systemtic Name: N,2-dicyclohexyl-2-[[2-(6-methoxy-1-benzothiophen-3-yl)-2-oxidanylidene-ethanoyl]-(2-piperazin-1-ylethyl)amino]ethanamide Openeye Name: N,2-dicyclohexyl-2-[[2-(6-methoxybenzothiophen-3-yl)-2-oxo-acetyl]-(2-piperazin-1-ylethyl)amino]acetamide CAS Name: N,2-dicyclohexyl-2-[[2-(6-methoxy-1-benzothiophen-3-yl)-1,2-dioxoethyl]-[2-(1-piperazinyl)ethyl]amino]acetamide IUPAC Name: N,2-dicyclohexyl-2-[[2-(6-methoxy-1-benzothiophen-3-yl)-2-oxoacetyl]-(2-piperazin-1-ylethyl)amino]acetamide Traditional Name: N,2-dicyclohexyl-2-[[2-keto-2-(6-methoxybenzothiophen-3-yl)acetyl]-(2-piperazinoethyl)amino]acetamide Formula: C31H44N4O4S MolecularWeight: 568.77046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CS2)C(=O)C(=O)N(CCN3CCNCC3)C(C4CCCCC4)C(=O)NC5CCCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CS2)C(=O)C(=O)N(CCN3CCNCC3)C(C4CCCCC4)C(=O)NC5CCCCC5

InChI

InChI=1S/C31H44N4O4S/c1-39-24-12-13-25-26(21-40-27(25)20-24)29(36)31(38)35(19-18-34-16-14-32-15-17-34)28(22-8-4-2-5-9-22)30(37)33-23-10-6-3-7-11-23/h12-13,20-23,28,32H,2-11,14-19H2,1H3,(H,33,37)