4-methyl-2-(2-naphthalen-1-ylethanoylcarbamothioylamino)-5-(phenylmethyl)thiophene-3-carboxamide

Systemtic Name: 4-methyl-2-(2-naphthalen-1-ylethanoylcarbamothioylamino)-5-(phenylmethyl)thiophene-3-carboxamide Openeye Name: 5-benzyl-4-methyl-2-[[2-(1-naphthyl)acetyl]carbamothioylamino]thiophene-3-carboxamide CAS Name: 4-methyl-2-[[[[2-(1-naphthalenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-5-(phenylmethyl)-3-thiophenecarboxamide IUPAC Name: 5-benzyl-4-methyl-2-[(2-naphthalen-1-ylacetyl)carbamothioylamino]thiophene-3-carboxamide Traditional Name: 5-benzyl-4-methyl-2-[[2-(1-naphthyl)acetyl]thiocarbamoylamino]thiophene-3-carboxamide Formula: C26H23N3O2S2 MolecularWeight: 473.60972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)CC2=CC=CC3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)CC2=CC=CC3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C26H23N3O2S2/c1-16-21(14-17-8-3-2-4-9-17)33-25(23(16)24(27)31)29-26(32)28-22(30)15-19-12-7-11-18-10-5-6-13-20(18)19/h2-13H,14-15H2,1H3,(H2,27,31)(H2,28,29,30,32)