methyl 5-methyl-4-phenyl-2-[(4-propan-2-ylphenyl)carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-4-phenyl-2-[(4-propan-2-ylphenyl)carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[(4-isopropylphenyl)carbamothioylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-4-phenyl-2-[[(4-propan-2-ylanilino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-4-phenyl-2-[(4-propan-2-ylphenyl)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-methyl-2-(p-cumenylthiocarbamoylamino)-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C23H24N2O2S2 MolecularWeight: 424.57886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=S)NC2=CC=C(C=C2)C(C)C)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(S1)NC(=S)NC2=CC=C(C=C2)C(C)C)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C23H24N2O2S2/c1-14(2)16-10-12-18(13-11-16)24-23(28)25-21-20(22(26)27-4)19(15(3)29-21)17-8-6-5-7-9-17/h5-14H,1-4H3,(H2,24,25,28)