2-[(1S)-1-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1,3-benzothiazole

Systemtic Name: 2-[(1S)-1-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1,3-benzothiazole Openeye Name: 2-[(1S)-1-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1,3-benzothiazole CAS Name: 2-[(1S)-1-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]ethyl]-1,3-benzothiazole IUPAC Name: 2-[(1S)-1-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1,3-benzothiazole Traditional Name: 2-[(1S)-1-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]ethyl]-1,3-benzothiazole Formula: C20H18N4S2 MolecularWeight: 378.51372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)SC3=NN=C(N3C4=CC=CC=C4)C5CC5

Isomeric SMILES

C[C@@H](C1=NC2=CC=CC=C2S1)SC3=NN=C(N3C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C20H18N4S2/c1-13(19-21-16-9-5-6-10-17(16)26-19)25-20-23-22-18(14-11-12-14)24(20)15-7-3-2-4-8-15/h2-10,13-14H,11-12H2,1H3/t13-/m0/s1