ethyl 6-methyl-2-[(8-methyl-1-benzoxepin-4-yl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 6-methyl-2-[(8-methyl-1-benzoxepin-4-yl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 6-methyl-2-[(8-methyl-1-benzoxepine-4-carbonyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 6-methyl-2-[[(8-methyl-1-benzoxepin-4-yl)-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-2-[(8-methyl-1-benzoxepine-4-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 6-methyl-2-[(8-methyl-1-benzoxepin-4-carbonyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C24H25NO4S MolecularWeight: 423.5246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3=CC4=C(C=C(C=C4)C)OC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3=CC4=C(C=C(C=C4)C)OC=C3

InChI

InChI=1S/C24H25NO4S/c1-4-28-24(27)21-18-8-6-15(3)12-20(18)30-23(21)25-22(26)17-9-10-29-19-11-14(2)5-7-16(19)13-17/h5,7,9-11,13,15H,4,6,8,12H2,1-3H3,(H,25,26)