(E)-2-(4-methyl-1,3-thiazol-2-yl)-3-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]prop-2-enenitrile

Systemtic Name: (E)-2-(4-methyl-1,3-thiazol-2-yl)-3-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]prop-2-enenitrile Openeye Name: (E)-2-(4-methylthiazol-2-yl)-3-(4-pyrrolidin-1-ylsulfonylanilino)prop-2-enenitrile CAS Name: (E)-2-(4-methyl-2-thiazolyl)-3-[4-(1-pyrrolidinylsulfonyl)anilino]-2-propenenitrile IUPAC Name: (E)-2-(4-methyl-1,3-thiazol-2-yl)-3-(4-pyrrolidin-1-ylsulfonylanilino)prop-2-enenitrile Traditional Name: (E)-2-(4-methylthiazol-2-yl)-3-(4-pyrrolidinosulfonylanilino)acrylonitrile Formula: C17H18N4O2S2 MolecularWeight: 374.48042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(=CNC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C#N

Isomeric SMILES

CC1=CSC(=N1)/C(=C/NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)/C#N

InChI

InChI=1S/C17H18N4O2S2/c1-13-12-24-17(20-13)14(10-18)11-19-15-4-6-16(7-5-15)25(22,23)21-8-2-3-9-21/h4-7,11-12,19H,2-3,8-9H2,1H3/b14-11+