2,4-bis(chloranyl)-N-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)carbamothioyl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)carbamothioyl]benzamide Openeye Name: 2,4-dichloro-N-[[2-(4-pyridyl)-1,3-benzoxazol-5-yl]carbamothioyl]benzamide CAS Name: 2,4-dichloro-N-[[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 2,4-dichloro-N-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)carbamothioyl]benzamide Traditional Name: 2,4-dichloro-N-[[2-(4-pyridyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]benzamide Formula: C20H12Cl2N4O2S MolecularWeight: 443.30588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=S)NC(=O)C3=C(C=C(C=C3)Cl)Cl)N=C(O2)C4=CC=NC=C4

Isomeric SMILES

C1=CC2=C(C=C1NC(=S)NC(=O)C3=C(C=C(C=C3)Cl)Cl)N=C(O2)C4=CC=NC=C4

InChI

InChI=1S/C20H12Cl2N4O2S/c21-12-1-3-14(15(22)9-12)18(27)26-20(29)24-13-2-4-17-16(10-13)25-19(28-17)11-5-7-23-8-6-11/h1-10H,(H2,24,26,27,29)