[2-[(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 1-phenylcyclobutane-1-carboxylate

Systemtic Name: [2-[(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 1-phenylcyclobutane-1-carboxylate Openeye Name: [2-[(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl] 1-phenylcyclobutanecarboxylate CAS Name: 1-phenyl-1-cyclobutanecarboxylic acid [2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 1-phenylcyclobutane-1-carboxylate Traditional Name: 1-phenylcyclobutanecarboxylic acid [2-[(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-keto-ethyl] ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)COC(=O)C3(CCC3)C4=CC=CC=C4)C(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)COC(=O)C3(CCC3)C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C22H24N2O4S/c23-19(26)18-15-9-4-5-10-16(15)29-20(18)24-17(25)13-28-21(27)22(11-6-12-22)14-7-2-1-3-8-14/h1-3,7-8H,4-6,9-13H2,(H2,23,26)(H,24,25)