4-methyl-5-(phenylmethyl)-2-[(4-phenylphenyl)carbonylcarbamothioylamino]thiophene-3-carboxamide

Systemtic Name: 4-methyl-5-(phenylmethyl)-2-[(4-phenylphenyl)carbonylcarbamothioylamino]thiophene-3-carboxamide Openeye Name: 5-benzyl-4-methyl-2-[(4-phenylbenzoyl)carbamothioylamino]thiophene-3-carboxamide CAS Name: 4-methyl-2-[[[[oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]-5-(phenylmethyl)-3-thiophenecarboxamide IUPAC Name: 5-benzyl-4-methyl-2-[(4-phenylbenzoyl)carbamothioylamino]thiophene-3-carboxamide Traditional Name: 5-benzyl-4-methyl-2-[(4-phenylbenzoyl)thiocarbamoylamino]thiophene-3-carboxamide Formula: C27H23N3O2S2 MolecularWeight: 485.62042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H23N3O2S2/c1-17-22(16-18-8-4-2-5-9-18)34-26(23(17)24(28)31)30-27(33)29-25(32)21-14-12-20(13-15-21)19-10-6-3-7-11-19/h2-15H,16H2,1H3,(H2,28,31)(H2,29,30,32,33)