prop-2-enyl (4S,5R)-4-(4-butoxyphenyl)-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: prop-2-enyl (4S,5R)-4-(4-butoxyphenyl)-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate Openeye Name: allyl (4S,5R)-4-(4-butoxyphenyl)-6-methylene-2-thioxo-hexahydropyrimidine-5-carboxylate CAS Name: (4S,5R)-4-(4-butoxyphenyl)-6-methylene-2-sulfanylidene-1,3-diazinane-5-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (4S,5R)-4-(4-butoxyphenyl)-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate Traditional Name: (4S,5R)-4-(4-butoxyphenyl)-6-methylene-2-thioxo-hexahydropyrimidine-5-carboxylic acid allyl ester Formula: C19H24N2O3S MolecularWeight: 360.47046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2C(C(=C)NC(=S)N2)C(=O)OCC=C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)[C@@H]2[C@H](C(=C)NC(=S)N2)C(=O)OCC=C

InChI

InChI=1S/C19H24N2O3S/c1-4-6-12-23-15-9-7-14(8-10-15)17-16(18(22)24-11-5-2)13(3)20-19(25)21-17/h5,7-10,16-17H,2-4,6,11-12H2,1H3,(H2,20,21,25)/t16-,17+/m0/s1