(5S)-1-prop-2-enyl-5-(pyridin-3-ylmethyliminomethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5S)-1-prop-2-enyl-5-(pyridin-3-ylmethyliminomethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5S)-1-allyl-5-(3-pyridylmethyliminomethyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5S)-1-prop-2-enyl-5-(3-pyridinylmethyliminomethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5S)-1-prop-2-enyl-5-(pyridin-3-ylmethyliminomethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5S)-1-allyl-5-(3-pyridylmethyliminomethyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C14H14N4O2S MolecularWeight: 302.35156

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(C(=O)NC1=S)C=NCC2=CN=CC=C2

Isomeric SMILES

C=CCN1C(=O)[C@H](C(=O)NC1=S)C=NCC2=CN=CC=C2

InChI

InChI=1S/C14H14N4O2S/c1-2-6-18-13(20)11(12(19)17-14(18)21)9-16-8-10-4-3-5-15-7-10/h2-5,7,9,11H,1,6,8H2,(H,17,19,21)/t11-/m0/s1