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

Systemtic Name: (5S)-5-(cyclopropyliminomethyl)-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5S)-5-(cyclopropyliminomethyl)-1-(4-ethoxyphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5S)-5-(cyclopropyliminomethyl)-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5S)-5-(cyclopropyliminomethyl)-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5S)-5-(cyclopropyliminomethyl)-1-p-phenetyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(C(=O)NC2=S)C=NC3CC3

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)[C@H](C(=O)NC2=S)C=NC3CC3

InChI

InChI=1S/C16H17N3O3S/c1-2-22-12-7-5-11(6-8-12)19-15(21)13(9-17-10-3-4-10)14(20)18-16(19)23/h5-10,13H,2-4H2,1H3,(H,18,20,23)/t13-/m0/s1