methyl 2-[bis(prop-2-enyl)carbamothioylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[bis(prop-2-enyl)carbamothioylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-(diallylcarbamothioylamino)-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[bis(prop-2-enyl)amino]-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[bis(prop-2-enyl)carbamothioylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-(diallylthiocarbamoylamino)-5-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C19H20N2O2S2 MolecularWeight: 372.5043

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)N(CC=C)CC=C

Isomeric SMILES

COC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)N(CC=C)CC=C

InChI

InChI=1S/C19H20N2O2S2/c1-4-11-21(12-5-2)19(24)20-17-15(18(22)23-3)13-16(25-17)14-9-7-6-8-10-14/h4-10,13H,1-2,11-12H2,3H3,(H,20,24)