5-(4-chlorophenyl)-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-1,2-oxazole-3-carboxamide Openeye Name: 5-(4-chlorophenyl)-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)isoxazole-3-carboxamide CAS Name: 5-(4-chlorophenyl)-N-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]-3-isoxazolecarboxamide IUPAC Name: 5-(4-chlorophenyl)-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-1,2-oxazole-3-carboxamide Traditional Name: 5-(4-chlorophenyl)-N-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]isoxazole-3-carboxamide Formula: C20H13ClN4O3S2 MolecularWeight: 456.92522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)NC(=O)C3=NOC(=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)NC(=O)C3=NOC(=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H13ClN4O3S2/c21-14-8-6-13(7-9-14)17-10-15(25-28-17)18(27)22-19-23-24-20(30-19)29-11-16(26)12-4-2-1-3-5-12/h1-10H,11H2,(H,22,23,27)