6-azanyl-1-(3H-benzimidazol-5-ylmethyl)-6-(4-methylpiperidin-1-yl)-N-(2-oxidanylideneethyl)cyclohexa-2,4-diene-1-sulfonamide

Systemtic Name: 6-azanyl-1-(3H-benzimidazol-5-ylmethyl)-6-(4-methylpiperidin-1-yl)-N-(2-oxidanylideneethyl)cyclohexa-2,4-diene-1-sulfonamide Openeye Name: 6-amino-1-(3H-benzimidazol-5-ylmethyl)-6-(4-methyl-1-piperidyl)-N-(2-oxoethyl)cyclohexa-2,4-diene-1-sulfonamide CAS Name: 6-amino-1-(3H-benzimidazol-5-ylmethyl)-6-(4-methyl-1-piperidinyl)-N-(2-oxoethyl)-1-cyclohexa-2,4-dienesulfonamide IUPAC Name: 6-amino-1-(3H-benzimidazol-5-ylmethyl)-6-(4-methylpiperidin-1-yl)-N-(2-oxoethyl)cyclohexa-2,4-diene-1-sulfonamide Traditional Name: 6-amino-1-(3H-benzimidazol-5-ylmethyl)-N-(2-ketoethyl)-6-(4-methylpiperidino)cyclohexa-2,4-diene-1-sulfonamide Formula: C22H29N5O3S MolecularWeight: 443.56236

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2(C=CC=CC2(CC3=CC4=C(C=C3)N=CN4)S(=O)(=O)NCC=O)N

Isomeric SMILES

CC1CCN(CC1)C2(C=CC=CC2(CC3=CC4=C(C=C3)N=CN4)S(=O)(=O)NCC=O)N

InChI

InChI=1S/C22H29N5O3S/c1-17-6-11-27(12-7-17)22(23)9-3-2-8-21(22,31(29,30)26-10-13-28)15-18-4-5-19-20(14-18)25-16-24-19/h2-5,8-9,13-14,16-17,26H,6-7,10-12,15,23H2,1H3,(H,24,25)