(E)-2-(4-methyl-1,3-thiazol-2-yl)-3-[(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)amino]prop-2-enenitrile

Systemtic Name: (E)-2-(4-methyl-1,3-thiazol-2-yl)-3-[(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)amino]prop-2-enenitrile Openeye Name: (E)-3-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-anilino)-2-(4-methylthiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)anilino]-2-(4-methyl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-(2-hydroxy-5-pyrrolidin-1-ylsulfonylanilino)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(2-hydroxy-5-pyrrolidinosulfonyl-anilino)-2-(4-methylthiazol-2-yl)acrylonitrile Formula: C17H18N4O3S2 MolecularWeight: 390.47982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4O3S2/c1-12-11-25-17(20-12)13(9-18)10-19-15-8-14(4-5-16(15)22)26(23,24)21-6-2-3-7-21/h4-5,8,10-11,19,22H,2-3,6-7H2,1H3/b13-10+