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

Systemtic Name: 2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzothiazole Openeye Name: 2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1,3-benzothiazole CAS Name: 2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1,3-benzothiazole IUPAC Name: 2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzothiazole Traditional Name: 2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-1,3-benzothiazole Formula: C17H13N5S2 MolecularWeight: 351.44862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SC3=NC4=CC=CC=C4S3)C5=CC=NC=C5

Isomeric SMILES

C1CC1N2C(=NN=C2SC3=NC4=CC=CC=C4S3)C5=CC=NC=C5

InChI

InChI=1S/C17H13N5S2/c1-2-4-14-13(3-1)19-17(23-14)24-16-21-20-15(22(16)12-5-6-12)11-7-9-18-10-8-11/h1-4,7-10,12H,5-6H2