[2-methoxy-5-[[4-[4-methyl-3-(4-methylpiperazin-1-yl)sulfonyl-phenyl]phthalazin-1-yl]amino]phenyl]-piperidin-1-yl-methanone

Systemtic Name: [2-methoxy-5-[[4-[4-methyl-3-(4-methylpiperazin-1-yl)sulfonyl-phenyl]phthalazin-1-yl]amino]phenyl]-piperidin-1-yl-methanone Openeye Name: [2-methoxy-5-[[4-[4-methyl-3-(4-methylpiperazin-1-yl)sulfonyl-phenyl]phthalazin-1-yl]amino]phenyl]-(1-piperidyl)methanone CAS Name: [2-methoxy-5-[[4-[4-methyl-3-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-1-phthalazinyl]amino]phenyl]-(1-piperidinyl)methanone IUPAC Name: [2-methoxy-5-[[4-[4-methyl-3-(4-methylpiperazin-1-yl)sulfonylphenyl]phthalazin-1-yl]amino]phenyl]-piperidin-1-ylmethanone Traditional Name: [2-methoxy-5-[[4-[4-methyl-3-(4-methylpiperazino)sulfonyl-phenyl]phthalazin-1-yl]amino]phenyl]-piperidino-methanone Formula: C33H38N6O4S MolecularWeight: 614.75762

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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)OC)C(=O)N5CCCCC5)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)OC)C(=O)N5CCCCC5)S(=O)(=O)N6CCN(CC6)C

InChI

InChI=1S/C33H38N6O4S/c1-23-11-12-24(21-30(23)44(41,42)39-19-17-37(2)18-20-39)31-26-9-5-6-10-27(26)32(36-35-31)34-25-13-14-29(43-3)28(22-25)33(40)38-15-7-4-8-16-38/h5-6,9-14,21-22H,4,7-8,15-20H2,1-3H3,(H,34,36)