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

Systemtic Name: (E)-3-[(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-[2-methoxy-5-(1-piperidylsulfonyl)anilino]-2-(4-methylthiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-[2-methoxy-5-(1-piperidinylsulfonyl)anilino]-2-(4-methyl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-(2-methoxy-5-piperidin-1-ylsulfonylanilino)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(2-methoxy-5-piperidinosulfonyl-anilino)-2-(4-methylthiazol-2-yl)acrylonitrile Formula: C19H22N4O3S2 MolecularWeight: 418.53298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(=CNC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OC)C#N

Isomeric SMILES

CC1=CSC(=N1)/C(=C/NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OC)/C#N

InChI

InChI=1S/C19H22N4O3S2/c1-14-13-27-19(22-14)15(11-20)12-21-17-10-16(6-7-18(17)26-2)28(24,25)23-8-4-3-5-9-23/h6-7,10,12-13,21H,3-5,8-9H2,1-2H3/b15-12+