2-[2-azanylidene-5-(phenylmethyl)-1,3,4-thiadiazol-3-yl]-1-(3,4-dimethoxyphenyl)ethanone

Systemtic Name: 2-[2-azanylidene-5-(phenylmethyl)-1,3,4-thiadiazol-3-yl]-1-(3,4-dimethoxyphenyl)ethanone Openeye Name: 2-(5-benzyl-2-imino-1,3,4-thiadiazol-3-yl)-1-(3,4-dimethoxyphenyl)ethanone CAS Name: 1-(3,4-dimethoxyphenyl)-2-[2-imino-5-(phenylmethyl)-1,3,4-thiadiazol-3-yl]ethanone IUPAC Name: 2-(5-benzyl-2-imino-1,3,4-thiadiazol-3-yl)-1-(3,4-dimethoxyphenyl)ethanone Traditional Name: 2-(5-benzyl-2-imino-1,3,4-thiadiazol-3-yl)-1-(3,4-dimethoxyphenyl)ethanone Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CN2C(=N)SC(=N2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CN2C(=N)SC(=N2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C19H19N3O3S/c1-24-16-9-8-14(11-17(16)25-2)15(23)12-22-19(20)26-18(21-22)10-13-6-4-3-5-7-13/h3-9,11,20H,10,12H2,1-2H3