(2S)-3-azanylidene-2-[2-[(3,4-dimethylphenyl)amino]-1,3-thiazol-4-yl]butanenitrile

Systemtic Name: (2S)-3-azanylidene-2-[2-[(3,4-dimethylphenyl)amino]-1,3-thiazol-4-yl]butanenitrile Openeye Name: (2S)-2-[2-(3,4-dimethylanilino)thiazol-4-yl]-3-imino-butanenitrile CAS Name: (2S)-2-[2-(3,4-dimethylanilino)-4-thiazolyl]-3-iminobutanenitrile IUPAC Name: (2S)-2-[2-(3,4-dimethylanilino)-1,3-thiazol-4-yl]-3-iminobutanenitrile Traditional Name: (2S)-2-[2-(3,4-dimethylanilino)thiazol-4-yl]-3-imino-butyronitrile Formula: C15H16N4S MolecularWeight: 284.37934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC(=CS2)C(C#N)C(=N)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC(=CS2)[C@H](C#N)C(=N)C)C

InChI

InChI=1S/C15H16N4S/c1-9-4-5-12(6-10(9)2)18-15-19-14(8-20-15)13(7-16)11(3)17/h4-6,8,13,17H,1-3H3,(H,18,19)/t13-/m1/s1