N-[2-methyl-3-(3-methylbutanoylcarbamothioylamino)phenyl]cyclopropanecarboxamide

Systemtic Name: N-[2-methyl-3-(3-methylbutanoylcarbamothioylamino)phenyl]cyclopropanecarboxamide Openeye Name: N-[2-methyl-3-(3-methylbutanoylcarbamothioylamino)phenyl]cyclopropanecarboxamide CAS Name: N-[2-methyl-3-[[[(3-methyl-1-oxobutyl)amino]-sulfanylidenemethyl]amino]phenyl]cyclopropanecarboxamide IUPAC Name: N-[2-methyl-3-(3-methylbutanoylcarbamothioylamino)phenyl]cyclopropanecarboxamide Traditional Name: N-[3-(isovalerylthiocarbamoylamino)-2-methyl-phenyl]cyclopropanecarboxamide Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=S)NC(=O)CC(C)C)NC(=O)C2CC2

Isomeric SMILES

CC1=C(C=CC=C1NC(=S)NC(=O)CC(C)C)NC(=O)C2CC2

InChI

InChI=1S/C17H23N3O2S/c1-10(2)9-15(21)20-17(23)19-14-6-4-5-13(11(14)3)18-16(22)12-7-8-12/h4-6,10,12H,7-9H2,1-3H3,(H,18,22)(H2,19,20,21,23)