methyl 5-methyl-2-[(2-methyl-6-propan-2-yl-phenyl)carbamothioylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-2-[(2-methyl-6-propan-2-yl-phenyl)carbamothioylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2-isopropyl-6-methyl-phenyl)carbamothioylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-2-[[(2-methyl-6-propan-2-ylanilino)-sulfanylidenemethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-2-[(2-methyl-6-propan-2-ylphenyl)carbamothioylamino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(2-isopropyl-6-methyl-phenyl)thiocarbamoylamino]-5-methyl-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(=CC=C1)C(C)C)NC(=S)NC2=C(C(=C(S2)C)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=S)NC2=C(C(=C(S2)C)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C24H26N2O2S2/c1-14(2)18-13-9-10-15(3)21(18)25-24(29)26-22-20(23(27)28-5)19(16(4)30-22)17-11-7-6-8-12-17/h6-14H,1-5H3,(H2,25,26,29)