N-[bis(azanyl)methylidene]-4-[1-(4-methylsulfonylphenyl)carbonylpiperidin-4-yl]benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-[1-(4-methylsulfonylphenyl)carbonylpiperidin-4-yl]benzamide Openeye Name: N-(diaminomethylene)-4-[1-(4-methylsulfonylbenzoyl)-4-piperidyl]benzamide CAS Name: N-(diaminomethylidene)-4-[1-[(4-methylsulfonylphenyl)-oxomethyl]-4-piperidinyl]benzamide IUPAC Name: N-(diaminomethylidene)-4-[1-(4-methylsulfonylbenzoyl)piperidin-4-yl]benzamide Traditional Name: N-(diaminomethylene)-4-[1-(4-mesylbenzoyl)-4-piperidyl]benzamide Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCC(CC2)C3=CC=C(C=C3)C(=O)N=C(N)N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCC(CC2)C3=CC=C(C=C3)C(=O)N=C(N)N

InChI

InChI=1S/C21H24N4O4S/c1-30(28,29)18-8-6-17(7-9-18)20(27)25-12-10-15(11-13-25)14-2-4-16(5-3-14)19(26)24-21(22)23/h2-9,15H,10-13H2,1H3,(H4,22,23,24,26)