ethyl 4-cyclopropyl-2-[(2,4-dimethylphenyl)carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-cyclopropyl-2-[(2,4-dimethylphenyl)carbamothioylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-cyclopropyl-2-[(2,4-dimethylphenyl)carbamothioylamino]thiophene-3-carboxylate CAS Name: 4-cyclopropyl-2-[[(2,4-dimethylanilino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyclopropyl-2-[(2,4-dimethylphenyl)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 4-cyclopropyl-2-[(2,4-dimethylphenyl)thiocarbamoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C19H22N2O2S2 MolecularWeight: 374.52018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2CC2)NC(=S)NC3=C(C=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2CC2)NC(=S)NC3=C(C=C(C=C3)C)C

InChI

InChI=1S/C19H22N2O2S2/c1-4-23-18(22)16-14(13-6-7-13)10-25-17(16)21-19(24)20-15-8-5-11(2)9-12(15)3/h5,8-10,13H,4,6-7H2,1-3H3,(H2,20,21,24)