4-[(6,6-dimethyl-3-methylsulfanyl-4-oxidanylidene-5,7-dihydro-2-benzothiophen-1-yl)carbonylamino]-N-[2-(2-naphthalen-1-ylethanoylamino)ethyl]piperidine-4-carboxamide

Systemtic Name: 4-[(6,6-dimethyl-3-methylsulfanyl-4-oxidanylidene-5,7-dihydro-2-benzothiophen-1-yl)carbonylamino]-N-[2-(2-naphthalen-1-ylethanoylamino)ethyl]piperidine-4-carboxamide Openeye Name: 4-[(6,6-dimethyl-3-methylsulfanyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carbonyl)amino]-N-[2-[[2-(1-naphthyl)acetyl]amino]ethyl]piperidine-4-carboxamide CAS Name: 4-[[[6,6-dimethyl-3-(methylthio)-4-oxo-5,7-dihydro-2-benzothiophen-1-yl]-oxomethyl]amino]-N-[2-[[2-(1-naphthalenyl)-1-oxoethyl]amino]ethyl]-4-piperidinecarboxamide IUPAC Name: 4-[(6,6-dimethyl-3-methylsulfanyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carbonyl)amino]-N-[2-[(2-naphthalen-1-ylacetyl)amino]ethyl]piperidine-4-carboxamide Traditional Name: 4-[[4-keto-6,6-dimethyl-3-(methylthio)-5,7-dihydroisobenzothiophene-1-carbonyl]amino]-N-[2-[[2-(1-naphthyl)acetyl]amino]ethyl]isonipecotamide Formula: C32H38N4O4S2 MolecularWeight: 606.79852

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(SC(=C2C(=O)C1)SC)C(=O)NC3(CCNCC3)C(=O)NCCNC(=O)CC4=CC=CC5=CC=CC=C54)C

Isomeric SMILES

CC1(CC2=C(SC(=C2C(=O)C1)SC)C(=O)NC3(CCNCC3)C(=O)NCCNC(=O)CC4=CC=CC5=CC=CC=C54)C

InChI

InChI=1S/C32H38N4O4S2/c1-31(2)18-23-26(24(37)19-31)29(41-3)42-27(23)28(39)36-32(11-13-33-14-12-32)30(40)35-16-15-34-25(38)17-21-9-6-8-20-7-4-5-10-22(20)21/h4-10,33H,11-19H2,1-3H3,(H,34,38)(H,35,40)(H,36,39)