N-[4-[(2-phenylethanoylcarbamothioylamino)carbamoyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[(2-phenylethanoylcarbamothioylamino)carbamoyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[4-[[(2-phenylacetyl)carbamothioylamino]carbamoyl]phenyl]cyclopropanecarboxamide CAS Name: N-[4-[oxo-[[[(1-oxo-2-phenylethyl)amino]-sulfanylidenemethyl]hydrazo]methyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[[(2-phenylacetyl)carbamothioylamino]carbamoyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[4-[[(2-phenylacetyl)thiocarbamoylamino]carbamoyl]phenyl]cyclopropanecarboxamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CC1C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H20N4O3S/c25-17(12-13-4-2-1-3-5-13)22-20(28)24-23-19(27)15-8-10-16(11-9-15)21-18(26)14-6-7-14/h1-5,8-11,14H,6-7,12H2,(H,21,26)(H,23,27)(H2,22,24,25,28)