methyl 2-[(4-methoxycarbonylphenyl)carbamoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[(4-methoxycarbonylphenyl)carbamoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 6-(1,1-dimethylpropyl)-2-[(4-methoxycarbonylphenyl)carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[(4-methoxycarbonylanilino)-oxomethyl]amino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[(4-methoxycarbonylphenyl)carbamoylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 6-tert-amyl-2-[(4-carbomethoxyphenyl)carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C24H30N2O5S/c1-6-24(2,3)15-9-12-17-18(13-15)32-20(19(17)22(28)31-5)26-23(29)25-16-10-7-14(8-11-16)21(27)30-4/h7-8,10-11,15H,6,9,12-13H2,1-5H3,(H2,25,26,29)