4-azanyl-2-[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-propyl]sulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-propyl]sulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxo-propyl]sulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxopropyl]thio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxopropyl]sulfanylpyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-keto-propyl]thio]pyrimidine-5-carbonitrile Formula: C16H11N7OS MolecularWeight: 349.36984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)CSC3=NC=C(C(=N3)N)C#N)N2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)CSC3=NC=C(C(=N3)N)C#N)N2

InChI

InChI=1S/C16H11N7OS/c17-5-9-7-20-16(23-14(9)19)25-8-13(24)10(6-18)15-21-11-3-1-2-4-12(11)22-15/h1-4,7,21-22H,8H2,(H2,19,20,23)