4-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-phenyl-butan-1-one

Systemtic Name: 4-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-phenyl-butan-1-one Openeye Name: 4-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-phenyl-butan-1-one CAS Name: 4-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]thio]-1-phenyl-1-butanone IUPAC Name: 4-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-phenylbutan-1-one Traditional Name: 4-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]thio]-1-phenyl-butan-1-one Formula: C18H23N3OS2 MolecularWeight: 361.52472

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NN=C(S2)SCCCC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)NC2=NN=C(S2)SCCCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H23N3OS2/c22-16(14-8-3-1-4-9-14)12-7-13-23-18-21-20-17(24-18)19-15-10-5-2-6-11-15/h1,3-4,8-9,15H,2,5-7,10-13H2,(H,19,20)