(2-azanylpyridin-4-yl)-[4-[(4-thiophen-3-yl-1,2,3-triazol-1-yl)methyl]piperidin-1-yl]methanone

Systemtic Name: (2-azanylpyridin-4-yl)-[4-[(4-thiophen-3-yl-1,2,3-triazol-1-yl)methyl]piperidin-1-yl]methanone Openeye Name: (2-amino-4-pyridyl)-[4-[[4-(3-thienyl)triazol-1-yl]methyl]-1-piperidyl]methanone CAS Name: (2-amino-4-pyridinyl)-[4-[[4-(3-thiophenyl)-1-triazolyl]methyl]-1-piperidinyl]methanone IUPAC Name: (2-aminopyridin-4-yl)-[4-[(4-thiophen-3-yltriazol-1-yl)methyl]piperidin-1-yl]methanone Traditional Name: (2-amino-4-pyridyl)-[4-[[4-(3-thienyl)triazol-1-yl]methyl]piperidino]methanone Formula: C18H20N6OS MolecularWeight: 368.456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2C=C(N=N2)C3=CSC=C3)C(=O)C4=CC(=NC=C4)N

Isomeric SMILES

C1CN(CCC1CN2C=C(N=N2)C3=CSC=C3)C(=O)C4=CC(=NC=C4)N

InChI

InChI=1S/C18H20N6OS/c19-17-9-14(1-5-20-17)18(25)23-6-2-13(3-7-23)10-24-11-16(21-22-24)15-4-8-26-12-15/h1,4-5,8-9,11-13H,2-3,6-7,10H2,(H2,19,20)