4-chloranyl-N-[(4-chlorophenyl)carbonyl-(pyridin-3-ylmethyl)carbamothioyl]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 4-chloranyl-N-[(4-chlorophenyl)carbonyl-(pyridin-3-ylmethyl)carbamothioyl]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 4-chloro-N-[(4-chlorobenzoyl)-(3-pyridylmethyl)carbamothioyl]-N-(3-pyridylmethyl)benzamide CAS Name: 4-chloro-N-[[[(4-chlorophenyl)-oxomethyl]-(3-pyridinylmethyl)amino]-sulfanylidenemethyl]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 4-chloro-N-[(4-chlorobenzoyl)-(pyridin-3-ylmethyl)carbamothioyl]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-chloro-N-[(4-chlorobenzoyl)-(3-pyridylmethyl)thiocarbamoyl]-N-(3-pyridylmethyl)benzamide Formula: C27H20Cl2N4O2S MolecularWeight: 535.4443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CN(C(=O)C2=CC=C(C=C2)Cl)C(=S)N(CC3=CN=CC=C3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC(=CN=C1)CN(C(=O)C2=CC=C(C=C2)Cl)C(=S)N(CC3=CN=CC=C3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H20Cl2N4O2S/c28-23-9-5-21(6-10-23)25(34)32(17-19-3-1-13-30-15-19)27(36)33(18-20-4-2-14-31-16-20)26(35)22-7-11-24(29)12-8-22/h1-16H,17-18H2