2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[4-(1-azepanylsulfonyl)anilino]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[4-(azepan-1-ylsulfonyl)anilino]-1-(4-phenylpiperazino)ethanone Formula: C24H32N4O3S MolecularWeight: 456.60088

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NCC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NCC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H32N4O3S/c29-24(27-18-16-26(17-19-27)22-8-4-3-5-9-22)20-25-21-10-12-23(13-11-21)32(30,31)28-14-6-1-2-7-15-28/h3-5,8-13,25H,1-2,6-7,14-20H2