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

Systemtic Name: 1-[(4-cyano-3-methyl-1-oxidanylidene-pyrido[1,2-a]benzimidazol-2-ylidene)methylamino]-3-ethyl-thiourea Openeye Name: 1-[(4-cyano-3-methyl-1-oxo-pyrido[1,2-a]benzimidazol-2-ylidene)methylamino]-3-ethyl-thiourea CAS Name: 1-[(4-cyano-3-methyl-1-oxo-2-pyrido[1,2-a]benzimidazolylidene)methylamino]-3-ethylthiourea IUPAC Name: 1-[(4-cyano-3-methyl-1-oxopyrido[1,2-a]benzimidazol-2-ylidene)methylamino]-3-ethylthiourea Traditional Name: 1-[(4-cyano-1-keto-3-methyl-pyrido[1,2-a]benzimidazol-2-ylidene)methylamino]-3-ethyl-thiourea Formula: C17H16N6OS MolecularWeight: 352.41354

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC=C1C(=C(C2=NC3=CC=CC=C3N2C1=O)C#N)C

Isomeric SMILES

CCNC(=S)NNC=C1C(=C(C2=NC3=CC=CC=C3N2C1=O)C#N)C

InChI

InChI=1S/C17H16N6OS/c1-3-19-17(25)22-20-9-12-10(2)11(8-18)15-21-13-6-4-5-7-14(13)23(15)16(12)24/h4-7,9,20H,3H2,1-2H3,(H2,19,22,25)