N-methyl-3-[[[3-oxidanylidene-3-[(phenylmethyl)amino]propyl]carbamothioylamino]methyl]benzamide

Systemtic Name: N-methyl-3-[[[3-oxidanylidene-3-[(phenylmethyl)amino]propyl]carbamothioylamino]methyl]benzamide Openeye Name: 3-[[[3-(benzylamino)-3-oxo-propyl]carbamothioylamino]methyl]-N-methyl-benzamide CAS Name: N-methyl-3-[[[[[3-oxo-3-[(phenylmethyl)amino]propyl]amino]-sulfanylidenemethyl]amino]methyl]benzamide IUPAC Name: 3-[[[3-(benzylamino)-3-oxopropyl]carbamothioylamino]methyl]-N-methylbenzamide Traditional Name: 3-[[[3-(benzylamino)-3-keto-propyl]thiocarbamoylamino]methyl]-N-methyl-benzamide Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)CNC(=S)NCCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)CNC(=S)NCCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C20H24N4O2S/c1-21-19(26)17-9-5-8-16(12-17)14-24-20(27)22-11-10-18(25)23-13-15-6-3-2-4-7-15/h2-9,12H,10-11,13-14H2,1H3,(H,21,26)(H,23,25)(H2,22,24,27)