N-cyclopropyl-N-[5-[(2-phenoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: N-cyclopropyl-N-[5-[(2-phenoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: N-cyclopropyl-N-[5-[(2-phenoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide CAS Name: N-cyclopropyl-N-[5-[(2-phenoxyphenyl)methylthio]-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: N-cyclopropyl-N-[5-[(2-phenoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: N-cyclopropyl-N-[5-[(2-phenoxybenzyl)thio]-1,3,4-thiadiazol-2-yl]propionamide Formula: C21H21N3O2S2 MolecularWeight: 411.54034

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1CC1)C2=NN=C(S2)SCC3=CC=CC=C3OC4=CC=CC=C4

Isomeric SMILES

CCC(=O)N(C1CC1)C2=NN=C(S2)SCC3=CC=CC=C3OC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O2S2/c1-2-19(25)24(16-12-13-16)20-22-23-21(28-20)27-14-15-8-6-7-11-18(15)26-17-9-4-3-5-10-17/h3-11,16H,2,12-14H2,1H3