1-phenyl-2-phenylazanyl-7-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-1,6-naphthyridin-4-one

Systemtic Name: 1-phenyl-2-phenylazanyl-7-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-1,6-naphthyridin-4-one Openeye Name: 2-anilino-7-(4-benzylsulfonylpiperazin-1-yl)-1-phenyl-1,6-naphthyridin-4-one CAS Name: 2-anilino-1-phenyl-7-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-1,6-naphthyridin-4-one IUPAC Name: 2-anilino-7-(4-benzylsulfonylpiperazin-1-yl)-1-phenyl-1,6-naphthyridin-4-one Traditional Name: 2-anilino-7-(4-benzylsulfonylpiperazino)-1-phenyl-1,6-naphthyridin-4-one Formula: C31H29N5O3S MolecularWeight: 551.65866

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C3C(=C2)N(C(=CC3=O)NC4=CC=CC=C4)C5=CC=CC=C5)S(=O)(=O)CC6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=NC=C3C(=C2)N(C(=CC3=O)NC4=CC=CC=C4)C5=CC=CC=C5)S(=O)(=O)CC6=CC=CC=C6

InChI

InChI=1S/C31H29N5O3S/c37-29-21-31(33-25-12-6-2-7-13-25)36(26-14-8-3-9-15-26)28-20-30(32-22-27(28)29)34-16-18-35(19-17-34)40(38,39)23-24-10-4-1-5-11-24/h1-15,20-22,33H,16-19,23H2