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

Systemtic Name: 4-azanyl-2-[3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxidanylidene-propyl]sulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxo-propyl]sulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[[3-cyano-3-(1,3-dimethyl-2-benzimidazolylidene)-2-oxopropyl]thio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxopropyl]sulfanylpyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[[3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-keto-propyl]thio]pyrimidine-5-carbonitrile Formula: C18H15N7OS MolecularWeight: 377.423

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)CSC3=NC=C(C(=N3)N)C#N)C

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)CSC3=NC=C(C(=N3)N)C#N)C

InChI

InChI=1S/C18H15N7OS/c1-24-13-5-3-4-6-14(13)25(2)17(24)12(8-20)15(26)10-27-18-22-9-11(7-19)16(21)23-18/h3-6,9H,10H2,1-2H3,(H2,21,22,23)