N-[3-[(4-phenylmethoxyphenyl)carbonylcarbamothioylamino]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[(4-phenylmethoxyphenyl)carbonylcarbamothioylamino]phenyl]thiophene-2-carboxamide Openeye Name: N-[3-[(4-benzyloxybenzoyl)carbamothioylamino]phenyl]thiophene-2-carboxamide CAS Name: N-[3-[[[[oxo-(4-phenylmethoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[(4-phenylmethoxybenzoyl)carbamothioylamino]phenyl]thiophene-2-carboxamide Traditional Name: N-[3-[(4-benzoxybenzoyl)thiocarbamoylamino]phenyl]thiophene-2-carboxamide Formula: C26H21N3O3S2 MolecularWeight: 487.59324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NC(=S)NC3=CC=CC(=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NC(=S)NC3=CC=CC(=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C26H21N3O3S2/c30-24(19-11-13-22(14-12-19)32-17-18-6-2-1-3-7-18)29-26(33)28-21-9-4-8-20(16-21)27-25(31)23-10-5-15-34-23/h1-16H,17H2,(H,27,31)(H2,28,29,30,33)