N-(3-chloranyl-2-methyl-phenyl)-4-fluoranyl-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-4-fluoranyl-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-4-fluoro-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(3-chloro-2-methylphenyl)-4-fluoro-3-[(4-methyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(3-chloro-2-methylphenyl)-4-fluoro-3-(4-methylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-4-fluoro-3-(4-methylpiperazino)sulfonyl-benzamide Formula: C19H21ClFN3O3S MolecularWeight: 425.904743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCN(CC3)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCN(CC3)C

InChI

InChI=1S/C19H21ClFN3O3S/c1-13-15(20)4-3-5-17(13)22-19(25)14-6-7-16(21)18(12-14)28(26,27)24-10-8-23(2)9-11-24/h3-7,12H,8-11H2,1-2H3,(H,22,25)