N-[(E)-[2-(azepan-1-yl)-2-oxidanylidene-1-phenyl-ethylidene]amino]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(E)-[2-(azepan-1-yl)-2-oxidanylidene-1-phenyl-ethylidene]amino]-4-methyl-benzenesulfonamide Openeye Name: N-[(E)-[2-(azepan-1-yl)-2-oxo-1-phenyl-ethylidene]amino]-4-methyl-benzenesulfonamide CAS Name: N-[(E)-[2-(1-azepanyl)-2-oxo-1-phenylethylidene]amino]-4-methylbenzenesulfonamide IUPAC Name: N-[(E)-[2-(azepan-1-yl)-2-oxo-1-phenylethylidene]amino]-4-methylbenzenesulfonamide Traditional Name: N-[(E)-[2-(azepan-1-yl)-2-keto-1-phenyl-ethylidene]amino]-4-methyl-benzenesulfonamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NN=C(C2=CC=CC=C2)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N/N=C(\C2=CC=CC=C2)/C(=O)N3CCCCCC3

InChI

InChI=1S/C21H25N3O3S/c1-17-11-13-19(14-12-17)28(26,27)23-22-20(18-9-5-4-6-10-18)21(25)24-15-7-2-3-8-16-24/h4-6,9-14,23H,2-3,7-8,15-16H2,1H3/b22-20+