N-[(3-azanyl-3-oxidanylidene-propyl)-(phenylmethyl)carbamothioyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[(3-azanyl-3-oxidanylidene-propyl)-(phenylmethyl)carbamothioyl]-2,2-dimethyl-propanamide Openeye Name: N-[(3-amino-3-oxo-propyl)-benzyl-carbamothioyl]-2,2-dimethyl-propanamide CAS Name: N-[[(3-amino-3-oxopropyl)-(phenylmethyl)amino]-sulfanylidenemethyl]-2,2-dimethylpropanamide IUPAC Name: N-[(3-amino-3-oxopropyl)-benzylcarbamothioyl]-2,2-dimethylpropanamide Traditional Name: N-[(3-amino-3-keto-propyl)-benzyl-thiocarbamoyl]-2,2-dimethyl-propionamide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(=S)N(CCC(=O)N)CC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)C(=O)NC(=S)N(CCC(=O)N)CC1=CC=CC=C1

InChI

InChI=1S/C16H23N3O2S/c1-16(2,3)14(21)18-15(22)19(10-9-13(17)20)11-12-7-5-4-6-8-12/h4-8H,9-11H2,1-3H3,(H2,17,20)(H,18,21,22)