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

Systemtic Name: (E)-3-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-[2-methyl-5-(1-piperidylsulfonyl)anilino]-2-(4-methylthiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-[2-methyl-5-(1-piperidinylsulfonyl)anilino]-2-(4-methyl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-(2-methyl-5-piperidin-1-ylsulfonylanilino)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(2-methyl-5-piperidinosulfonyl-anilino)-2-(4-methylthiazol-2-yl)acrylonitrile Formula: C19H22N4O2S2 MolecularWeight: 402.53358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC=C(C#N)C3=NC(=CS3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)N/C=C(\C#N)/C3=NC(=CS3)C

InChI

InChI=1S/C19H22N4O2S2/c1-14-6-7-17(27(24,25)23-8-4-3-5-9-23)10-18(14)21-12-16(11-20)19-22-15(2)13-26-19/h6-7,10,12-13,21H,3-5,8-9H2,1-2H3/b16-12+