1-[[4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]phenyl]methyl]-3-propan-2-yl-urea

Systemtic Name: 1-[[4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]phenyl]methyl]-3-propan-2-yl-urea Openeye Name: 1-isopropyl-3-[[4-[4-(p-tolylsulfonyl)-1,4-diazepane-1-carbonyl]phenyl]methyl]urea CAS Name: 1-[[4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-oxomethyl]phenyl]methyl]-3-propan-2-ylurea IUPAC Name: 1-[[4-[4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carbonyl]phenyl]methyl]-3-propan-2-ylurea Traditional Name: 1-isopropyl-3-[4-(4-tosyl-1,4-diazepane-1-carbonyl)benzyl]urea Formula: C24H32N4O4S MolecularWeight: 472.60028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)C3=CC=C(C=C3)CNC(=O)NC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)C3=CC=C(C=C3)CNC(=O)NC(C)C

InChI

InChI=1S/C24H32N4O4S/c1-18(2)26-24(30)25-17-20-7-9-21(10-8-20)23(29)27-13-4-14-28(16-15-27)33(31,32)22-11-5-19(3)6-12-22/h5-12,18H,4,13-17H2,1-3H3,(H2,25,26,30)