methyl 5-methyl-4-phenyl-2-(4-phenylbutan-2-ylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-4-phenyl-2-(4-phenylbutan-2-ylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: methyl 5-methyl-2-[(1-methyl-3-phenyl-propyl)carbamothioylamino]-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-4-phenyl-2-[[(4-phenylbutan-2-ylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-4-phenyl-2-(4-phenylbutan-2-ylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 5-methyl-2-[(1-methyl-3-phenyl-propyl)thiocarbamoylamino]-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C24H26N2O2S2 MolecularWeight: 438.60544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=S)NC(C)CCC2=CC=CC=C2)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(S1)NC(=S)NC(C)CCC2=CC=CC=C2)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C24H26N2O2S2/c1-16(14-15-18-10-6-4-7-11-18)25-24(29)26-22-21(23(27)28-3)20(17(2)30-22)19-12-8-5-9-13-19/h4-13,16H,14-15H2,1-3H3,(H2,25,26,29)