4-[[4-[4-methyl-3-(4-methylpiperazin-1-yl)sulfonyl-phenyl]phthalazin-1-yl]amino]-N-phenyl-benzamide

Systemtic Name: 4-[[4-[4-methyl-3-(4-methylpiperazin-1-yl)sulfonyl-phenyl]phthalazin-1-yl]amino]-N-phenyl-benzamide Openeye Name: 4-[[4-[4-methyl-3-(4-methylpiperazin-1-yl)sulfonyl-phenyl]phthalazin-1-yl]amino]-N-phenyl-benzamide CAS Name: 4-[[4-[4-methyl-3-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-1-phthalazinyl]amino]-N-phenylbenzamide IUPAC Name: 4-[[4-[4-methyl-3-(4-methylpiperazin-1-yl)sulfonylphenyl]phthalazin-1-yl]amino]-N-phenylbenzamide Traditional Name: 4-[[4-[4-methyl-3-(4-methylpiperazino)sulfonyl-phenyl]phthalazin-1-yl]amino]-N-phenyl-benzamide Formula: C33H32N6O3S MolecularWeight: 592.71058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)C(=O)NC5=CC=CC=C5)S(=O)(=O)N6CCN(CC6)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)C(=O)NC5=CC=CC=C5)S(=O)(=O)N6CCN(CC6)C

InChI

InChI=1S/C33H32N6O3S/c1-23-12-13-25(22-30(23)43(41,42)39-20-18-38(2)19-21-39)31-28-10-6-7-11-29(28)32(37-36-31)34-27-16-14-24(15-17-27)33(40)35-26-8-4-3-5-9-26/h3-17,22H,18-21H2,1-2H3,(H,34,37)(H,35,40)