2-[(4-bromophenyl)sulfonyl-methyl-amino]-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]ethanamide

Systemtic Name: 2-[(4-bromophenyl)sulfonyl-methyl-amino]-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]ethanamide Openeye Name: 2-[(4-bromophenyl)sulfonyl-methyl-amino]-N-[[4-(isopropylcarbamoylamino)phenyl]methyl]acetamide CAS Name: 2-[(4-bromophenyl)sulfonyl-methylamino]-N-[[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]acetamide IUPAC Name: 2-[(4-bromophenyl)sulfonyl-methylamino]-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]acetamide Traditional Name: 2-[brosyl(methyl)amino]-N-[4-(isopropylcarbamoylamino)benzyl]acetamide Formula: C20H25BrN4O4S MolecularWeight: 497.4059

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C20H25BrN4O4S/c1-14(2)23-20(27)24-17-8-4-15(5-9-17)12-22-19(26)13-25(3)30(28,29)18-10-6-16(21)7-11-18/h4-11,14H,12-13H2,1-3H3,(H,22,26)(H2,23,24,27)