(5S)-5-(2-dimethylaminoethyliminomethyl)-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5S)-5-(2-dimethylaminoethyliminomethyl)-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5S)-5-(2-dimethylaminoethyliminomethyl)-1-(4-ethoxyphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5S)-5-(2-dimethylaminoethyliminomethyl)-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5S)-5-(2-dimethylaminoethyliminomethyl)-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5S)-5-(2-dimethylaminoethyliminomethyl)-1-p-phenetyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(C(=O)NC2=S)C=NCCN(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)[C@H](C(=O)NC2=S)C=NCCN(C)C

InChI

InChI=1S/C17H22N4O3S/c1-4-24-13-7-5-12(6-8-13)21-16(23)14(15(22)19-17(21)25)11-18-9-10-20(2)3/h5-8,11,14H,4,9-10H2,1-3H3,(H,19,22,25)/t14-/m0/s1