2-[(4-azanyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(cyclohexen-1-yl)ethyl]propanamide

Systemtic Name: 2-[(4-azanyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(cyclohexen-1-yl)ethyl]propanamide Openeye Name: 2-[[4-amino-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(cyclohexen-1-yl)ethyl]propanamide CAS Name: 2-[(4-amino-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-N-[2-(1-cyclohexenyl)ethyl]propanamide IUPAC Name: 2-[(4-amino-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(cyclohexen-1-yl)ethyl]propanamide Traditional Name: 2-[[4-amino-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-N-[2-(cyclohexen-1-yl)ethyl]propionamide Formula: C18H24N6OS MolecularWeight: 372.48776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CCCCC1)SC2=NN=C(N2N)C3=CC=NC=C3

Isomeric SMILES

CC(C(=O)NCCC1=CCCCC1)SC2=NN=C(N2N)C3=CC=NC=C3

InChI

InChI=1S/C18H24N6OS/c1-13(17(25)21-12-7-14-5-3-2-4-6-14)26-18-23-22-16(24(18)19)15-8-10-20-11-9-15/h5,8-11,13H,2-4,6-7,12,19H2,1H3,(H,21,25)