N-[[4-(1-cyanocyclopentyl)phenyl]carbamothioyl]-3-methyl-butanamide

Systemtic Name: N-[[4-(1-cyanocyclopentyl)phenyl]carbamothioyl]-3-methyl-butanamide Openeye Name: N-[[4-(1-cyanocyclopentyl)phenyl]carbamothioyl]-3-methyl-butanamide CAS Name: N-[[4-(1-cyanocyclopentyl)anilino]-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[[4-(1-cyanocyclopentyl)phenyl]carbamothioyl]-3-methylbutanamide Traditional Name: N-[[4-(1-cyanocyclopentyl)phenyl]thiocarbamoyl]-3-methyl-butyramide Formula: C18H23N3OS MolecularWeight: 329.45972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NC1=CC=C(C=C1)C2(CCCC2)C#N

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=CC=C(C=C1)C2(CCCC2)C#N

InChI

InChI=1S/C18H23N3OS/c1-13(2)11-16(22)21-17(23)20-15-7-5-14(6-8-15)18(12-19)9-3-4-10-18/h5-8,13H,3-4,9-11H2,1-2H3,(H2,20,21,22,23)