(2S)-3-[(1-methylbenzimidazol-2-yl)methylimino]-2-(4-methyl-1,3-thiazol-2-yl)propanenitrile

Systemtic Name: (2S)-3-[(1-methylbenzimidazol-2-yl)methylimino]-2-(4-methyl-1,3-thiazol-2-yl)propanenitrile Openeye Name: (2S)-3-[(1-methylbenzimidazol-2-yl)methylimino]-2-(4-methylthiazol-2-yl)propanenitrile CAS Name: (2S)-3-[(1-methyl-2-benzimidazolyl)methylimino]-2-(4-methyl-2-thiazolyl)propanenitrile IUPAC Name: (2S)-3-[(1-methylbenzimidazol-2-yl)methylimino]-2-(4-methyl-1,3-thiazol-2-yl)propanenitrile Traditional Name: (2S)-3-[(1-methylbenzimidazol-2-yl)methylimino]-2-(4-methylthiazol-2-yl)propionitrile Formula: C16H15N5S MolecularWeight: 309.3888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C=NCC2=NC3=CC=CC=C3N2C)C#N

Isomeric SMILES

CC1=CSC(=N1)[C@@H](C=NCC2=NC3=CC=CC=C3N2C)C#N

InChI

InChI=1S/C16H15N5S/c1-11-10-22-16(19-11)12(7-17)8-18-9-15-20-13-5-3-4-6-14(13)21(15)2/h3-6,8,10,12H,9H2,1-2H3/t12-/m1/s1