N-[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]-3-iodanyl-4-methoxy-benzamide

Systemtic Name: N-[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]-3-iodanyl-4-methoxy-benzamide Openeye Name: N-[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]-3-iodo-4-methoxy-benzamide CAS Name: N-[4-[[4-(diphenylmethyl)-1-piperazinyl]sulfonyl]phenyl]-3-iodo-4-methoxybenzamide IUPAC Name: N-[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]-3-iodo-4-methoxybenzamide Traditional Name: N-[4-(4-benzhydrylpiperazino)sulfonylphenyl]-3-iodo-4-methoxy-benzamide Formula: C31H30IN3O4S MolecularWeight: 667.55707

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)I

InChI

InChI=1S/C31H30IN3O4S/c1-39-29-17-12-25(22-28(29)32)31(36)33-26-13-15-27(16-14-26)40(37,38)35-20-18-34(19-21-35)30(23-8-4-2-5-9-23)24-10-6-3-7-11-24/h2-17,22,30H,18-21H2,1H3,(H,33,36)