1-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea

Systemtic Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea Openeye Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]-3-(p-tolyl)urea CAS Name: 1-[4-(1-azepanylsulfonyl)phenyl]-3-(4-methylphenyl)urea IUPAC Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-methylphenyl)urea Traditional Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]-3-(p-tolyl)urea Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H25N3O3S/c1-16-6-8-17(9-7-16)21-20(24)22-18-10-12-19(13-11-18)27(25,26)23-14-4-2-3-5-15-23/h6-13H,2-5,14-15H2,1H3,(H2,21,22,24)