4-[[2-[(4-cyanophenyl)sulfonyl-methyl-amino]ethanoyl-methyl-amino]methyl]-N-cyclopropyl-benzamide

Systemtic Name: 4-[[2-[(4-cyanophenyl)sulfonyl-methyl-amino]ethanoyl-methyl-amino]methyl]-N-cyclopropyl-benzamide Openeye Name: 4-[[[2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetyl]-methyl-amino]methyl]-N-cyclopropyl-benzamide CAS Name: 4-[[[2-[(4-cyanophenyl)sulfonyl-methylamino]-1-oxoethyl]-methylamino]methyl]-N-cyclopropylbenzamide IUPAC Name: 4-[[[2-[(4-cyanophenyl)sulfonyl-methylamino]acetyl]-methylamino]methyl]-N-cyclopropylbenzamide Traditional Name: 4-[[[2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetyl]-methyl-amino]methyl]-N-cyclopropyl-benzamide Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)NC2CC2)C(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)NC2CC2)C(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H24N4O4S/c1-25(14-17-3-7-18(8-4-17)22(28)24-19-9-10-19)21(27)15-26(2)31(29,30)20-11-5-16(13-23)6-12-20/h3-8,11-12,19H,9-10,14-15H2,1-2H3,(H,24,28)