7-azanyl-5-(1H-indol-3-yl)-4-oxidanylidene-2-sulfanylidene-4a,5-dihydropyrimido[4,5-d]pyrimidine-6-carbonitrile

Systemtic Name: 7-azanyl-5-(1H-indol-3-yl)-4-oxidanylidene-2-sulfanylidene-4a,5-dihydropyrimido[4,5-d]pyrimidine-6-carbonitrile Openeye Name: 7-amino-5-(1H-indol-3-yl)-4-oxo-2-thioxo-4a,5-dihydropyrimido[4,5-d]pyrimidine-6-carbonitrile CAS Name: 7-amino-5-(1H-indol-3-yl)-4-oxo-2-sulfanylidene-4a,5-dihydropyrimido[4,5-d]pyrimidine-6-carbonitrile IUPAC Name: 7-amino-5-(1H-indol-3-yl)-4-oxo-2-sulfanylidene-4a,5-dihydropyrimido[4,5-d]pyrimidine-6-carbonitrile Traditional Name: 7-amino-5-(1H-indol-3-yl)-4-keto-2-thioxo-4a,5-dihydropyrimido[4,5-d]pyrimidine-6-carbonitrile Formula: C15H11N7OS MolecularWeight: 337.35914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C3C4C(=O)NC(=S)N=C4N=C(N3C#N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C3C4C(=O)NC(=S)N=C4N=C(N3C#N)N

InChI

InChI=1S/C15H11N7OS/c16-6-22-11(8-5-18-9-4-2-1-3-7(8)9)10-12(19-14(22)17)20-15(24)21-13(10)23/h1-5,10-11,18H,(H3,17,19,20,21,23,24)