N-(3-carbamothioylphenyl)-4-[methyl(2-methylpropyl)amino]butanamide

Systemtic Name: N-(3-carbamothioylphenyl)-4-[methyl(2-methylpropyl)amino]butanamide Openeye Name: N-(3-carbamothioylphenyl)-4-[isobutyl(methyl)amino]butanamide CAS Name: N-(3-carbamothioylphenyl)-4-[methyl(2-methylpropyl)amino]butanamide IUPAC Name: N-(3-carbamothioylphenyl)-4-[methyl(2-methylpropyl)amino]butanamide Traditional Name: 4-[isobutyl(methyl)amino]-N-(3-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(=C1)C(=S)N

Isomeric SMILES

CC(C)CN(C)CCCC(=O)NC1=CC=CC(=C1)C(=S)N

InChI

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