methyl (Z)-2-cyano-3-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]amino]prop-2-enoate

Systemtic Name: methyl (Z)-2-cyano-3-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]amino]prop-2-enoate Openeye Name: methyl (Z)-2-cyano-3-[4-[(4-methyl-1-piperidyl)sulfonyl]anilino]prop-2-enoate CAS Name: (Z)-2-cyano-3-[4-[(4-methyl-1-piperidinyl)sulfonyl]anilino]-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-2-cyano-3-[4-(4-methylpiperidin-1-yl)sulfonylanilino]prop-2-enoate Traditional Name: (Z)-2-cyano-3-[4-(4-methylpiperidino)sulfonylanilino]acrylic acid methyl ester Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC=C(C#N)C(=O)OC

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N/C=C(/C#N)\C(=O)OC

InChI

InChI=1S/C17H21N3O4S/c1-13-7-9-20(10-8-13)25(22,23)16-5-3-15(4-6-16)19-12-14(11-18)17(21)24-2/h3-6,12-13,19H,7-10H2,1-2H3/b14-12-