N-[2-methyl-5-(2-phenylethanoylcarbamothioylamino)phenyl]cyclopropanecarboxamide

Systemtic Name: N-[2-methyl-5-(2-phenylethanoylcarbamothioylamino)phenyl]cyclopropanecarboxamide Openeye Name: N-[2-methyl-5-[(2-phenylacetyl)carbamothioylamino]phenyl]cyclopropanecarboxamide CAS Name: N-[2-methyl-5-[[[(1-oxo-2-phenylethyl)amino]-sulfanylidenemethyl]amino]phenyl]cyclopropanecarboxamide IUPAC Name: N-[2-methyl-5-[(2-phenylacetyl)carbamothioylamino]phenyl]cyclopropanecarboxamide Traditional Name: N-[2-methyl-5-[(2-phenylacetyl)thiocarbamoylamino]phenyl]cyclopropanecarboxamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC(=O)CC2=CC=CC=C2)NC(=O)C3CC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC(=O)CC2=CC=CC=C2)NC(=O)C3CC3

InChI

InChI=1S/C20H21N3O2S/c1-13-7-10-16(12-17(13)22-19(25)15-8-9-15)21-20(26)23-18(24)11-14-5-3-2-4-6-14/h2-7,10,12,15H,8-9,11H2,1H3,(H,22,25)(H2,21,23,24,26)