3-phenylpropyl 4-[bis(prop-2-enyl)carbamothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: 3-phenylpropyl 4-[bis(prop-2-enyl)carbamothioylamino]-4-oxidanylidene-butanoate Openeye Name: 3-phenylpropyl 4-(diallylcarbamothioylamino)-4-oxo-butanoate CAS Name: 4-[[[bis(prop-2-enyl)amino]-sulfanylidenemethyl]amino]-4-oxobutanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-[bis(prop-2-enyl)carbamothioylamino]-4-oxobutanoate Traditional Name: 4-(diallylthiocarbamoylamino)-4-keto-butyric acid 3-phenylpropyl ester Formula: C20H26N2O3S MolecularWeight: 374.49704

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC=C)C(=S)NC(=O)CCC(=O)OCCCC1=CC=CC=C1

Isomeric SMILES

C=CCN(CC=C)C(=S)NC(=O)CCC(=O)OCCCC1=CC=CC=C1

InChI

InChI=1S/C20H26N2O3S/c1-3-14-22(15-4-2)20(26)21-18(23)12-13-19(24)25-16-8-11-17-9-6-5-7-10-17/h3-7,9-10H,1-2,8,11-16H2,(H,21,23,26)