1-(3-chloranyl-4-methoxy-phenyl)-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone

Systemtic Name: 1-(3-chloranyl-4-methoxy-phenyl)-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone Openeye Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(3-chloro-4-methoxy-phenyl)ethanone CAS Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-1-(3-chloro-4-methoxyphenyl)ethanone IUPAC Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(3-chloro-4-methoxyphenyl)ethanone Traditional Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-1-(3-chloro-4-methoxy-phenyl)ethanone Formula: C17H14ClN3O2S2 MolecularWeight: 391.89496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CSC2=NN=C(S2)NC3=CC=CC=C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CSC2=NN=C(S2)NC3=CC=CC=C3)Cl

InChI

InChI=1S/C17H14ClN3O2S2/c1-23-15-8-7-11(9-13(15)18)14(22)10-24-17-21-20-16(25-17)19-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,19,20)