N-(2-carbamothioylphenyl)-4-[methyl(2-methylpropyl)amino]butanamide

Systemtic Name: N-(2-carbamothioylphenyl)-4-[methyl(2-methylpropyl)amino]butanamide Openeye Name: N-(2-carbamothioylphenyl)-4-[isobutyl(methyl)amino]butanamide CAS Name: N-(2-carbamothioylphenyl)-4-[methyl(2-methylpropyl)amino]butanamide IUPAC Name: N-(2-carbamothioylphenyl)-4-[methyl(2-methylpropyl)amino]butanamide Traditional Name: 4-[isobutyl(methyl)amino]-N-(2-thiocarbamoylphenyl)butyramide Formula: C16H25N3OS MolecularWeight: 307.4542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C)CCCC(=O)NC1=CC=CC=C1C(=S)N

Isomeric SMILES

CC(C)CN(C)CCCC(=O)NC1=CC=CC=C1C(=S)N

InChI

InChI=1S/C16H25N3OS/c1-12(2)11-19(3)10-6-9-15(20)18-14-8-5-4-7-13(14)16(17)21/h4-5,7-8,12H,6,9-11H2,1-3H3,(H2,17,21)(H,18,20)