(4-chlorophenyl)methyl N-[3-(phenylmethylsulfanyl)-1,2,4-thiadiazol-5-yl]carbamate

Systemtic Name: (4-chlorophenyl)methyl N-[3-(phenylmethylsulfanyl)-1,2,4-thiadiazol-5-yl]carbamate Openeye Name: (4-chlorophenyl)methyl N-(3-benzylsulfanyl-1,2,4-thiadiazol-5-yl)carbamate CAS Name: N-[3-(phenylmethylthio)-1,2,4-thiadiazol-5-yl]carbamic acid (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)methyl N-(3-benzylsulfanyl-1,2,4-thiadiazol-5-yl)carbamate Traditional Name: N-[3-(benzylthio)-1,2,4-thiadiazol-5-yl]carbamic acid (4-chlorobenzyl) ester Formula: C17H14ClN3O2S2 MolecularWeight: 391.89496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NSC(=N2)NC(=O)OCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NSC(=N2)NC(=O)OCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClN3O2S2/c18-14-8-6-12(7-9-14)10-23-17(22)20-15-19-16(21-25-15)24-11-13-4-2-1-3-5-13/h1-9H,10-11H2,(H,19,20,21,22)