2-(2,2-diphenylethanoylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

Systemtic Name: 2-(2,2-diphenylethanoylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate Openeye Name: 2-[(2,2-diphenylacetyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate CAS Name: 2-[(1-oxo-2,2-diphenylethyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate IUPAC Name: 2-[(2,2-diphenylacetyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate Traditional Name: 2-[(2,2-diphenylacetyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate Formula: C24H22NO3S- MolecularWeight: 404.50138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2C(=O)[O-])NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2C(=O)[O-])NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H23NO3S/c26-22(20(16-10-4-1-5-11-16)17-12-6-2-7-13-17)25-23-21(24(27)28)18-14-8-3-9-15-19(18)29-23/h1-2,4-7,10-13,20H,3,8-9,14-15H2,(H,25,26)(H,27,28)/p-1