2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[(4-morpholin-4-ylphenyl)methyl]propanamide

Systemtic Name: 2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[(4-morpholin-4-ylphenyl)methyl]propanamide Openeye Name: 2-(3-chloro-N-methylsulfonyl-anilino)-N-[(4-morpholinophenyl)methyl]propanamide CAS Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[[4-(4-morpholinyl)phenyl]methyl]propanamide IUPAC Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[(4-morpholin-4-ylphenyl)methyl]propanamide Traditional Name: 2-(3-chloro-N-mesyl-anilino)-N-(4-morpholinobenzyl)propionamide Formula: C21H26ClN3O4S MolecularWeight: 451.96684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)N2CCOCC2)N(C3=CC(=CC=C3)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)N2CCOCC2)N(C3=CC(=CC=C3)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H26ClN3O4S/c1-16(25(30(2,27)28)20-5-3-4-18(22)14-20)21(26)23-15-17-6-8-19(9-7-17)24-10-12-29-13-11-24/h3-9,14,16H,10-13,15H2,1-2H3,(H,23,26)