methyl 6-ethyl-2-[3-[3-[(6-ethyl-3-methoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-oxidanylidene-propyl]sulfanylpropanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 6-ethyl-2-[3-[3-[(6-ethyl-3-methoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-oxidanylidene-propyl]sulfanylpropanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 6-ethyl-2-[3-[3-[(6-ethyl-3-methoxycarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-3-oxo-propyl]sulfanylpropanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 6-ethyl-2-[[3-[[3-[(6-ethyl-3-methoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-oxopropyl]thio]-1-oxopropyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 6-ethyl-2-[3-[3-[(6-ethyl-3-methoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3-oxopropyl]sulfanylpropanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[3-[[3-[(3-carbomethoxy-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-3-keto-propyl]thio]propanoylamino]-6-ethyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C30H40N2O6S3 MolecularWeight: 620.8434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)CCSCCC(=O)NC3=C(C4=C(S3)CC(CC4)CC)C(=O)OC

Isomeric SMILES

CCC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)CCSCCC(=O)NC3=C(C4=C(S3)CC(CC4)CC)C(=O)OC

InChI

InChI=1S/C30H40N2O6S3/c1-5-17-7-9-19-21(15-17)40-27(25(19)29(35)37-3)31-23(33)11-13-39-14-12-24(34)32-28-26(30(36)38-4)20-10-8-18(6-2)16-22(20)41-28/h17-18H,5-16H2,1-4H3,(H,31,33)(H,32,34)