N-(3a,4,5,6-tetrahydro-1H-perimidin-2-yl)benzenesulfonamide

Systemtic Name: N-(3a,4,5,6-tetrahydro-1H-perimidin-2-yl)benzenesulfonamide Openeye Name: N-(3a,4,5,6-tetrahydro-1H-perimidin-2-yl)benzenesulfonamide CAS Name: N-(3a,4,5,6-tetrahydro-1H-perimidin-2-yl)benzenesulfonamide IUPAC Name: N-(3a,4,5,6-tetrahydro-1H-perimidin-2-yl)benzenesulfonamide Traditional Name: N-(3a,4,5,6-tetrahydro-1H-perimidin-2-yl)benzenesulfonamide Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C3=C(C1)C=CC=C3NC(=N2)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC2C3=C(C1)C=CC=C3NC(=N2)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C17H17N3O2S/c21-23(22,13-8-2-1-3-9-13)20-17-18-14-10-4-6-12-7-5-11-15(19-17)16(12)14/h1-4,6,8-10,15H,5,7,11H2,(H2,18,19,20)