N-[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]-4-heptoxy-benzamide

Systemtic Name: N-[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]-4-heptoxy-benzamide Openeye Name: N-[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]-4-heptoxy-benzamide CAS Name: N-[4-[[4-(diphenylmethyl)-1-piperazinyl]sulfonyl]phenyl]-4-heptoxybenzamide IUPAC Name: N-[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]-4-heptoxybenzamide Traditional Name: N-[4-(4-benzhydrylpiperazino)sulfonylphenyl]-4-heptoxy-benzamide Formula: C37H43N3O4S MolecularWeight: 625.82002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C37H43N3O4S/c1-2-3-4-5-12-29-44-34-21-17-32(18-22-34)37(41)38-33-19-23-35(24-20-33)45(42,43)40-27-25-39(26-28-40)36(30-13-8-6-9-14-30)31-15-10-7-11-16-31/h6-11,13-24,36H,2-5,12,25-29H2,1H3,(H,38,41)