N-[4-[2-[(2-cyanophenyl)sulfonyl-methyl-amino]ethanoylamino]phenyl]-2-methyl-propanamide

Systemtic Name: N-[4-[2-[(2-cyanophenyl)sulfonyl-methyl-amino]ethanoylamino]phenyl]-2-methyl-propanamide Openeye Name: N-[4-[[2-[(2-cyanophenyl)sulfonyl-methyl-amino]acetyl]amino]phenyl]-2-methyl-propanamide CAS Name: N-[4-[[2-[(2-cyanophenyl)sulfonyl-methylamino]-1-oxoethyl]amino]phenyl]-2-methylpropanamide IUPAC Name: N-[4-[[2-[(2-cyanophenyl)sulfonyl-methylamino]acetyl]amino]phenyl]-2-methylpropanamide Traditional Name: N-[4-[[2-[(2-cyanophenyl)sulfonyl-methyl-amino]acetyl]amino]phenyl]-2-methyl-propionamide Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)CN(C)S(=O)(=O)C2=CC=CC=C2C#N

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)CN(C)S(=O)(=O)C2=CC=CC=C2C#N

InChI

InChI=1S/C20H22N4O4S/c1-14(2)20(26)23-17-10-8-16(9-11-17)22-19(25)13-24(3)29(27,28)18-7-5-4-6-15(18)12-21/h4-11,14H,13H2,1-3H3,(H,22,25)(H,23,26)