[4-(phenylcarbamoyl)phenyl]methyl 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylate

Systemtic Name: [4-(phenylcarbamoyl)phenyl]methyl 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylate Openeye Name: [4-(phenylcarbamoyl)phenyl]methyl 6-methyl-2,3-dihydrobenzothiophene-2-carboxylate CAS Name: 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylic acid [4-[anilino(oxo)methyl]phenyl]methyl ester IUPAC Name: [4-(phenylcarbamoyl)phenyl]methyl 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylate Traditional Name: 6-methyl-2,3-dihydrobenzothiophene-2-carboxylic acid [4-(phenylcarbamoyl)benzyl] ester Formula: C24H21NO3S MolecularWeight: 403.49344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(S2)C(=O)OCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4)C=C1

Isomeric SMILES

CC1=CC2=C(CC(S2)C(=O)OCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4)C=C1

InChI

InChI=1S/C24H21NO3S/c1-16-7-10-19-14-22(29-21(19)13-16)24(27)28-15-17-8-11-18(12-9-17)23(26)25-20-5-3-2-4-6-20/h2-13,22H,14-15H2,1H3,(H,25,26)