1-[[(E)-(4-cyano-3-methyl-1-oxidanylidene-pyrido[1,2-a]benzimidazol-2-ylidene)methyl]amino]thiourea

Systemtic Name: 1-[[(E)-(4-cyano-3-methyl-1-oxidanylidene-pyrido[1,2-a]benzimidazol-2-ylidene)methyl]amino]thiourea Openeye Name: [[(E)-(4-cyano-3-methyl-1-oxo-pyrido[1,2-a]benzimidazol-2-ylidene)methyl]amino]thiourea CAS Name: [[(E)-(4-cyano-3-methyl-1-oxo-2-pyrido[1,2-a]benzimidazolylidene)methyl]amino]thiourea IUPAC Name: [[(E)-(4-cyano-3-methyl-1-oxopyrido[1,2-a]benzimidazol-2-ylidene)methyl]amino]thiourea Traditional Name: [[(E)-(4-cyano-1-keto-3-methyl-pyrido[1,2-a]benzimidazol-2-ylidene)methyl]amino]thiourea Formula: C15H12N6OS MolecularWeight: 324.36038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=O)C1=CNNC(=S)N)C#N

Isomeric SMILES

CC\1=C(C2=NC3=CC=CC=C3N2C(=O)/C1=C/NNC(=S)N)C#N

InChI

InChI=1S/C15H12N6OS/c1-8-9(6-16)13-19-11-4-2-3-5-12(11)21(13)14(22)10(8)7-18-20-15(17)23/h2-5,7,18H,1H3,(H3,17,20,23)/b10-7+