N-methyl-6-[[[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]carbamothioylamino]methyl]pyridine-2-carboxamide

Systemtic Name: N-methyl-6-[[[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]carbamothioylamino]methyl]pyridine-2-carboxamide Openeye Name: 6-[[[2-(benzylamino)-2-oxo-ethyl]carbamothioylamino]methyl]-N-methyl-pyridine-2-carboxamide CAS Name: N-methyl-6-[[[[[2-oxo-2-[(phenylmethyl)amino]ethyl]amino]-sulfanylidenemethyl]amino]methyl]-2-pyridinecarboxamide IUPAC Name: 6-[[[2-(benzylamino)-2-oxoethyl]carbamothioylamino]methyl]-N-methylpyridine-2-carboxamide Traditional Name: 6-[[[2-(benzylamino)-2-keto-ethyl]thiocarbamoylamino]methyl]-N-methyl-picolinamide Formula: C18H21N5O2S MolecularWeight: 371.45664

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NC(=CC=C1)CNC(=S)NCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CNC(=O)C1=NC(=CC=C1)CNC(=S)NCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C18H21N5O2S/c1-19-17(25)15-9-5-8-14(23-15)11-21-18(26)22-12-16(24)20-10-13-6-3-2-4-7-13/h2-9H,10-12H2,1H3,(H,19,25)(H,20,24)(H2,21,22,26)