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

Systemtic Name: N-[3-[(4-carbamothioylphenyl)carbonylamino]pyridin-4-yl]-3,4-dimethoxy-benzamide Openeye Name: N-[3-[(4-carbamothioylbenzoyl)amino]-4-pyridyl]-3,4-dimethoxy-benzamide CAS Name: N-[3-[[(4-carbamothioylphenyl)-oxomethyl]amino]-4-pyridinyl]-3,4-dimethoxybenzamide IUPAC Name: N-[3-[(4-carbamothioylbenzoyl)amino]pyridin-4-yl]-3,4-dimethoxybenzamide Traditional Name: 3,4-dimethoxy-N-[3-[(4-thiocarbamoylbenzoyl)amino]-4-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(C=NC=C2)NC(=O)C3=CC=C(C=C3)C(=S)N)OC

Isomeric SMILES

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

InChI

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