ethyl 3-[(2-methylphenyl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 3-[(2-methylphenyl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-[(2-methylbenzoyl)amino]-4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 3-[[(2-methylphenyl)-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-methylbenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 3-(o-toluoylamino)-4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid ethyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)CCCC2)NC(=O)C3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)CCCC2)NC(=O)C3=CC=CC=C3C

InChI

InChI=1S/C19H21NO3S/c1-3-23-19(22)17-16(14-10-6-7-11-15(14)24-17)20-18(21)13-9-5-4-8-12(13)2/h4-5,8-9H,3,6-7,10-11H2,1-2H3,(H,20,21)