1-[4-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]carbonylphenyl]-3-phenyl-urea

Systemtic Name: 1-[4-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]carbonylphenyl]-3-phenyl-urea Openeye Name: 1-[4-[4-(azepan-1-ylsulfonyl)piperazine-1-carbonyl]phenyl]-3-phenyl-urea CAS Name: 1-[4-[[4-(1-azepanylsulfonyl)-1-piperazinyl]-oxomethyl]phenyl]-3-phenylurea IUPAC Name: 1-[4-[4-(azepan-1-ylsulfonyl)piperazine-1-carbonyl]phenyl]-3-phenylurea Traditional Name: 1-[4-[4-(azepan-1-ylsulfonyl)piperazine-1-carbonyl]phenyl]-3-phenyl-urea Formula: C24H31N5O4S MolecularWeight: 485.59904

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)NC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)NC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C24H31N5O4S/c30-23(20-10-12-22(13-11-20)26-24(31)25-21-8-4-3-5-9-21)27-16-18-29(19-17-27)34(32,33)28-14-6-1-2-7-15-28/h3-5,8-13H,1-2,6-7,14-19H2,(H2,25,26,31)