2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanenitrile

Systemtic Name: 2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanenitrile Openeye Name: 2-(4-methylthiazol-2-yl)-3-oxo-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanenitrile CAS Name: 2-(4-methyl-2-thiazolyl)-3-oxo-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanenitrile IUPAC Name: 2-(4-methyl-1,3-thiazol-2-yl)-3-oxo-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanenitrile Traditional Name: 3-keto-2-(4-methylthiazol-2-yl)-3-(4-pyrrolidinosulfonylphenyl)propionitrile Formula: C17H17N3O3S2 MolecularWeight: 375.46518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C#N)C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CSC(=N1)C(C#N)C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C17H17N3O3S2/c1-12-11-24-17(19-12)15(10-18)16(21)13-4-6-14(7-5-13)25(22,23)20-8-2-3-9-20/h4-7,11,15H,2-3,8-9H2,1H3