4-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-quinazoline

Systemtic Name: 4-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-quinazoline Openeye Name: 4-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-quinazoline CAS Name: 4-[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]-2-phenylquinazoline IUPAC Name: 4-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-phenylquinazoline Traditional Name: 4-[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]-2-phenyl-quinazoline Formula: C18H15N5S MolecularWeight: 333.4102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1)SC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCC1=NC(=NN1)SC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C18H15N5S/c1-2-15-20-18(23-22-15)24-17-13-10-6-7-11-14(13)19-16(21-17)12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,20,22,23)