N-[5-[(2-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-2-propan-2-ylsulfanyl-benzamide

Systemtic Name: N-[5-[(2-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-2-propan-2-ylsulfanyl-benzamide Openeye Name: 2-isopropylsulfanyl-N-[5-[(2-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: N-[5-[(2-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-2-(propan-2-ylthio)benzamide IUPAC Name: N-[5-[(2-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-2-propan-2-ylsulfanylbenzamide Traditional Name: 2-(isopropylthio)-N-(5-o-anisyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=CC=C1C(=O)NC2=NN=C(S2)CC3=CC=CC=C3OC

Isomeric SMILES

CC(C)SC1=CC=CC=C1C(=O)NC2=NN=C(S2)CC3=CC=CC=C3OC

InChI

InChI=1S/C20H21N3O2S2/c1-13(2)26-17-11-7-5-9-15(17)19(24)21-20-23-22-18(27-20)12-14-8-4-6-10-16(14)25-3/h4-11,13H,12H2,1-3H3,(H,21,23,24)