[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(4-phenylphenyl)methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(4-phenylphenyl)methanone Openeye Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(4-phenylphenyl)methanone CAS Name: [4-(1-azepanylsulfonyl)-1-piperazinyl]-(4-phenylphenyl)methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(4-phenylphenyl)methanone Traditional Name: [4-(azepan-1-ylsulfonyl)piperazino]-(4-phenylphenyl)methanone Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H29N3O3S/c27-23(22-12-10-21(11-13-22)20-8-4-3-5-9-20)24-16-18-26(19-17-24)30(28,29)25-14-6-1-2-7-15-25/h3-5,8-13H,1-2,6-7,14-19H2