4-(aminomethyl)-N-[2-[(4-methylphenyl)sulfonylamino]pyridin-4-yl]cyclohexane-1-carboxamide

Systemtic Name: 4-(aminomethyl)-N-[2-[(4-methylphenyl)sulfonylamino]pyridin-4-yl]cyclohexane-1-carboxamide Openeye Name: 4-(aminomethyl)-N-[2-(p-tolylsulfonylamino)-4-pyridyl]cyclohexanecarboxamide CAS Name: 4-(aminomethyl)-N-[2-[(4-methylphenyl)sulfonylamino]-4-pyridinyl]-1-cyclohexanecarboxamide IUPAC Name: 4-(aminomethyl)-N-[2-[(4-methylphenyl)sulfonylamino]pyridin-4-yl]cyclohexane-1-carboxamide Traditional Name: 4-(aminomethyl)-N-[2-(tosylamino)-4-pyridyl]cyclohexanecarboxamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC(=C2)NC(=O)C3CCC(CC3)CN

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC(=C2)NC(=O)C3CCC(CC3)CN

InChI

InChI=1S/C20H26N4O3S/c1-14-2-8-18(9-3-14)28(26,27)24-19-12-17(10-11-22-19)23-20(25)16-6-4-15(13-21)5-7-16/h2-3,8-12,15-16H,4-7,13,21H2,1H3,(H2,22,23,24,25)