7-azanyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-5-propan-2-yl-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile

Systemtic Name: 7-azanyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-5-propan-2-yl-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile Openeye Name: 7-amino-2-benzylsulfanyl-5-isopropyl-4-oxo-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile CAS Name: 7-amino-4-oxo-2-(phenylmethylthio)-5-propan-2-yl-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile IUPAC Name: 7-amino-2-benzylsulfanyl-4-oxo-5-propan-2-yl-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile Traditional Name: 7-amino-2-(benzylthio)-5-isopropyl-4-keto-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=C(OC2=C1C(=O)NC(=N2)SCC3=CC=CC=C3)N)C#N

Isomeric SMILES

CC(C)C1C(=C(OC2=C1C(=O)NC(=N2)SCC3=CC=CC=C3)N)C#N

InChI

InChI=1S/C18H18N4O2S/c1-10(2)13-12(8-19)15(20)24-17-14(13)16(23)21-18(22-17)25-9-11-6-4-3-5-7-11/h3-7,10,13H,9,20H2,1-2H3,(H,21,22,23)