2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]propanamide

Systemtic Name: 2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]propanamide Openeye Name: 2-(3-chloro-N-methylsulfonyl-anilino)-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]propanamide CAS Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[[4-(2-methyl-1-imidazolyl)phenyl]methyl]propanamide IUPAC Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]propanamide Traditional Name: 2-(3-chloro-N-mesyl-anilino)-N-[4-(2-methylimidazol-1-yl)benzyl]propionamide Formula: C21H23ClN4O3S MolecularWeight: 446.95032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=C(C=C2)CNC(=O)C(C)N(C3=CC(=CC=C3)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=NC=CN1C2=CC=C(C=C2)CNC(=O)C(C)N(C3=CC(=CC=C3)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H23ClN4O3S/c1-15(26(30(3,28)29)20-6-4-5-18(22)13-20)21(27)24-14-17-7-9-19(10-8-17)25-12-11-23-16(25)2/h4-13,15H,14H2,1-3H3,(H,24,27)