2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-[3-(4-methylpiperazin-1-yl)propyl]ethanamide

Systemtic Name: 2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-[3-(4-methylpiperazin-1-yl)propyl]ethanamide Openeye Name: 2-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide CAS Name: 2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[3-(4-methyl-1-piperazinyl)propyl]acetamide IUPAC Name: 2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide Traditional Name: 2-(3-chloro-N-mesyl-4-methoxy-anilino)-N-[3-(4-methylpiperazino)propyl]acetamide Formula: C18H29ClN4O4S MolecularWeight: 432.96526

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNC(=O)CN(C2=CC(=C(C=C2)OC)Cl)S(=O)(=O)C

Isomeric SMILES

CN1CCN(CC1)CCCNC(=O)CN(C2=CC(=C(C=C2)OC)Cl)S(=O)(=O)C

InChI

InChI=1S/C18H29ClN4O4S/c1-21-9-11-22(12-10-21)8-4-7-20-18(24)14-23(28(3,25)26)15-5-6-17(27-2)16(19)13-15/h5-6,13H,4,7-12,14H2,1-3H3,(H,20,24)