ethyl 4-[bis(prop-2-enyl)carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[bis(prop-2-enyl)carbamothioylamino]benzoate Openeye Name: ethyl 4-(diallylcarbamothioylamino)benzoate CAS Name: 4-[[[bis(prop-2-enyl)amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[bis(prop-2-enyl)carbamothioylamino]benzoate Traditional Name: 4-(diallylthiocarbamoylamino)benzoic acid ethyl ester Formula: C16H20N2O2S MolecularWeight: 304.4072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)N(CC=C)CC=C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)N(CC=C)CC=C

InChI

InChI=1S/C16H20N2O2S/c1-4-11-18(12-5-2)16(21)17-14-9-7-13(8-10-14)15(19)20-6-3/h4-5,7-10H,1-2,6,11-12H2,3H3,(H,17,21)