(2E)-4-azanyl-2-[1H-benzimidazol-2-yl(cyano)methylidene]-3-(3-methylphenyl)-1,3-thiazole-5-carboxamide

Systemtic Name: (2E)-4-azanyl-2-[1H-benzimidazol-2-yl(cyano)methylidene]-3-(3-methylphenyl)-1,3-thiazole-5-carboxamide Openeye Name: (2E)-4-amino-2-[1H-benzimidazol-2-yl(cyano)methylene]-3-(m-tolyl)thiazole-5-carboxamide CAS Name: (2E)-4-amino-2-[1H-benzimidazol-2-yl(cyano)methylidene]-3-(3-methylphenyl)-5-thiazolecarboxamide IUPAC Name: (2E)-4-amino-2-[1H-benzimidazol-2-yl(cyano)methylidene]-3-(3-methylphenyl)-1,3-thiazole-5-carboxamide Traditional Name: (2E)-4-amino-2-[1H-benzimidazol-2-yl(cyano)methylene]-3-(m-tolyl)-4-thiazoline-5-carboxamide Formula: C20H16N6OS MolecularWeight: 388.44564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(SC2=C(C#N)C3=NC4=CC=CC=C4N3)C(=O)N)N

Isomeric SMILES

CC1=CC(=CC=C1)N\2C(=C(S/C2=C(\C#N)/C3=NC4=CC=CC=C4N3)C(=O)N)N

InChI

InChI=1S/C20H16N6OS/c1-11-5-4-6-12(9-11)26-17(22)16(18(23)27)28-20(26)13(10-21)19-24-14-7-2-3-8-15(14)25-19/h2-9H,22H2,1H3,(H2,23,27)(H,24,25)/b20-13+