methyl 2-[bis(2-phenylethanoyl)amino]-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[bis(2-phenylethanoyl)amino]-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[bis(2-phenylacetyl)amino]-6-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[bis(1-oxo-2-phenylethyl)amino]-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[bis(2-phenylacetyl)amino]-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[bis(2-phenylacetyl)amino]-6-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C30H33NO4S MolecularWeight: 503.65232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)N(C(=O)CC3=CC=CC=C3)C(=O)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)N(C(=O)CC3=CC=CC=C3)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C30H33NO4S/c1-30(2,3)22-15-16-23-24(19-22)36-28(27(23)29(34)35-4)31(25(32)17-20-11-7-5-8-12-20)26(33)18-21-13-9-6-10-14-21/h5-14,22H,15-19H2,1-4H3