N-[3-[2-[(4-cyanophenyl)sulfonyl-methyl-amino]ethanoylamino]-4-methyl-phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[2-[(4-cyanophenyl)sulfonyl-methyl-amino]ethanoylamino]-4-methyl-phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[[2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetyl]amino]-4-methyl-phenyl]cyclopropanecarboxamide CAS Name: N-[3-[[2-[(4-cyanophenyl)sulfonyl-methylamino]-1-oxoethyl]amino]-4-methylphenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[[2-[(4-cyanophenyl)sulfonyl-methylamino]acetyl]amino]-4-methylphenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetyl]amino]-4-methyl-phenyl]cyclopropanecarboxamide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H22N4O4S/c1-14-3-8-17(23-21(27)16-6-7-16)11-19(14)24-20(26)13-25(2)30(28,29)18-9-4-15(12-22)5-10-18/h3-5,8-11,16H,6-7,13H2,1-2H3,(H,23,27)(H,24,26)