(2S)-2-(4-methyl-1,3-thiazol-2-yl)-3-(3-phenylsulfanylpropylimino)propanenitrile

Systemtic Name: (2S)-2-(4-methyl-1,3-thiazol-2-yl)-3-(3-phenylsulfanylpropylimino)propanenitrile Openeye Name: (2S)-2-(4-methylthiazol-2-yl)-3-(3-phenylsulfanylpropylimino)propanenitrile CAS Name: (2S)-2-(4-methyl-2-thiazolyl)-3-[3-(phenylthio)propylimino]propanenitrile IUPAC Name: (2S)-2-(4-methyl-1,3-thiazol-2-yl)-3-(3-phenylsulfanylpropylimino)propanenitrile Traditional Name: (2S)-2-(4-methylthiazol-2-yl)-3-[3-(phenylthio)propylimino]propionitrile Formula: C16H17N3S2 MolecularWeight: 315.45628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C=NCCCSC2=CC=CC=C2)C#N

Isomeric SMILES

CC1=CSC(=N1)[C@@H](C=NCCCSC2=CC=CC=C2)C#N

InChI

InChI=1S/C16H17N3S2/c1-13-12-21-16(19-13)14(10-17)11-18-8-5-9-20-15-6-3-2-4-7-15/h2-4,6-7,11-12,14H,5,8-9H2,1H3/t14-/m1/s1