5-(oxan-2-ylmethylsulfanyl)-N-phenethyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(oxan-2-ylmethylsulfanyl)-N-phenethyl-1,3,4-thiadiazol-2-amine Openeye Name: N-phenethyl-5-(tetrahydropyran-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-(2-oxanylmethylthio)-N-phenethyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(oxan-2-ylmethylsulfanyl)-N-phenethyl-1,3,4-thiadiazol-2-amine Traditional Name: phenethyl-[5-(tetrahydropyran-2-ylmethylthio)-1,3,4-thiadiazol-2-yl]amine Formula: C16H21N3OS2 MolecularWeight: 335.48744

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CSC2=NN=C(S2)NCCC3=CC=CC=C3

Isomeric SMILES

C1CCOC(C1)CSC2=NN=C(S2)NCCC3=CC=CC=C3

InChI

InChI=1S/C16H21N3OS2/c1-2-6-13(7-3-1)9-10-17-15-18-19-16(22-15)21-12-14-8-4-5-11-20-14/h1-3,6-7,14H,4-5,8-12H2,(H,17,18)