N-[2-[(4-carbamothioylphenyl)carbonylamino]pyridin-3-yl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[2-[(4-carbamothioylphenyl)carbonylamino]pyridin-3-yl]-3,4-dimethoxy-benzamide Openeye Name: N-[2-[(4-carbamothioylbenzoyl)amino]-3-pyridyl]-3,4-dimethoxy-benzamide CAS Name: N-[2-[[(4-carbamothioylphenyl)-oxomethyl]amino]-3-pyridinyl]-3,4-dimethoxybenzamide IUPAC Name: N-[2-[(4-carbamothioylbenzoyl)amino]pyridin-3-yl]-3,4-dimethoxybenzamide Traditional Name: 3,4-dimethoxy-N-[2-[(4-thiocarbamoylbenzoyl)amino]-3-pyridyl]benzamide Formula: C22H20N4O4S MolecularWeight: 436.4836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=C(N=CC=C2)NC(=O)C3=CC=C(C=C3)C(=S)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=C(N=CC=C2)NC(=O)C3=CC=C(C=C3)C(=S)N)OC

InChI

InChI=1S/C22H20N4O4S/c1-29-17-10-9-15(12-18(17)30-2)22(28)25-16-4-3-11-24-20(16)26-21(27)14-7-5-13(6-8-14)19(23)31/h3-12H,1-2H3,(H2,23,31)(H,25,28)(H,24,26,27)