2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-[3-(4-methylpiperazin-1-yl)propyl]propanamide

Systemtic Name: 2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-[3-(4-methylpiperazin-1-yl)propyl]propanamide Openeye Name: 2-(5-chloro-2-methyl-N-methylsulfonyl-anilino)-N-[3-(4-methylpiperazin-1-yl)propyl]propanamide CAS Name: 2-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-[3-(4-methyl-1-piperazinyl)propyl]propanamide IUPAC Name: 2-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-[3-(4-methylpiperazin-1-yl)propyl]propanamide Traditional Name: 2-(5-chloro-N-mesyl-2-methyl-anilino)-N-[3-(4-methylpiperazino)propyl]propionamide Formula: C19H31ClN4O3S MolecularWeight: 430.99244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N(C(C)C(=O)NCCCN2CCN(CC2)C)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N(C(C)C(=O)NCCCN2CCN(CC2)C)S(=O)(=O)C

InChI

InChI=1S/C19H31ClN4O3S/c1-15-6-7-17(20)14-18(15)24(28(4,26)27)16(2)19(25)21-8-5-9-23-12-10-22(3)11-13-23/h6-7,14,16H,5,8-13H2,1-4H3,(H,21,25)