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

Systemtic Name: [2-methoxy-5-[[4-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)phthalazin-1-yl]amino]phenyl]-piperidin-1-yl-methanone Openeye Name: [2-methoxy-5-[[4-[4-methyl-3-(1-piperidylsulfonyl)phenyl]phthalazin-1-yl]amino]phenyl]-(1-piperidyl)methanone CAS Name: [2-methoxy-5-[[4-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-1-phthalazinyl]amino]phenyl]-(1-piperidinyl)methanone IUPAC Name: [2-methoxy-5-[[4-(4-methyl-3-piperidin-1-ylsulfonylphenyl)phthalazin-1-yl]amino]phenyl]-piperidin-1-ylmethanone Traditional Name: [2-methoxy-5-[[4-(4-methyl-3-piperidinosulfonyl-phenyl)phthalazin-1-yl]amino]phenyl]-piperidino-methanone Formula: C33H37N5O4S MolecularWeight: 599.74298

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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)N6CCCCC6

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)N6CCCCC6

InChI

InChI=1S/C33H37N5O4S/c1-23-13-14-24(21-30(23)43(40,41)38-19-9-4-10-20-38)31-26-11-5-6-12-27(26)32(36-35-31)34-25-15-16-29(42-2)28(22-25)33(39)37-17-7-3-8-18-37/h5-6,11-16,21-22H,3-4,7-10,17-20H2,1-2H3,(H,34,36)