N-[3-[[4-(cyclohexylmethyl)-1,4-diazepan-1-yl]carbonyl]phenyl]naphthalene-2-sulfonamide

Systemtic Name: N-[3-[[4-(cyclohexylmethyl)-1,4-diazepan-1-yl]carbonyl]phenyl]naphthalene-2-sulfonamide Openeye Name: N-[3-[4-(cyclohexylmethyl)-1,4-diazepane-1-carbonyl]phenyl]naphthalene-2-sulfonamide CAS Name: N-[3-[[4-(cyclohexylmethyl)-1,4-diazepan-1-yl]-oxomethyl]phenyl]-2-naphthalenesulfonamide IUPAC Name: N-[3-[4-(cyclohexylmethyl)-1,4-diazepane-1-carbonyl]phenyl]naphthalene-2-sulfonamide Traditional Name: N-[3-[4-(cyclohexylmethyl)-1,4-diazepane-1-carbonyl]phenyl]naphthalene-2-sulfonamide Formula: C29H35N3O3S MolecularWeight: 505.6715

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2CCCN(CC2)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCC(CC1)CN2CCCN(CC2)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C29H35N3O3S/c33-29(32-17-7-16-31(18-19-32)22-23-8-2-1-3-9-23)26-12-6-13-27(20-26)30-36(34,35)28-15-14-24-10-4-5-11-25(24)21-28/h4-6,10-15,20-21,23,30H,1-3,7-9,16-19,22H2