2-(2,2-dimethylpropanoylcarbamothioylamino)-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide

Systemtic Name: 2-(2,2-dimethylpropanoylcarbamothioylamino)-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide Openeye Name: 5-benzyl-2-(2,2-dimethylpropanoylcarbamothioylamino)-4-methyl-thiophene-3-carboxamide CAS Name: 2-[[[(2,2-dimethyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]-4-methyl-5-(phenylmethyl)-3-thiophenecarboxamide IUPAC Name: 5-benzyl-2-(2,2-dimethylpropanoylcarbamothioylamino)-4-methylthiophene-3-carboxamide Traditional Name: 5-benzyl-4-methyl-2-(pivaloylthiocarbamoylamino)thiophene-3-carboxamide Formula: C19H23N3O2S2 MolecularWeight: 389.53482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C(C)(C)C)CC2=CC=CC=C2

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C(C)(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C19H23N3O2S2/c1-11-13(10-12-8-6-5-7-9-12)26-16(14(11)15(20)23)21-18(25)22-17(24)19(2,3)4/h5-9H,10H2,1-4H3,(H2,20,23)(H2,21,22,24,25)