2-[(4-azanyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[1-(phenylmethyl)piperidin-4-yl]ethanamide

Systemtic Name: 2-[(4-azanyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[1-(phenylmethyl)piperidin-4-yl]ethanamide Openeye Name: 2-[[4-amino-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1-benzyl-4-piperidyl)acetamide CAS Name: 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-[1-(phenylmethyl)-4-piperidinyl]acetamide IUPAC Name: 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(1-benzylpiperidin-4-yl)acetamide Traditional Name: 2-[[4-amino-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-(1-benzyl-4-piperidyl)acetamide Formula: C20H24N6OS2 MolecularWeight: 428.57416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)CSC2=NN=C(N2N)C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC(=O)CSC2=NN=C(N2N)C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C20H24N6OS2/c21-26-19(17-7-4-12-28-17)23-24-20(26)29-14-18(27)22-16-8-10-25(11-9-16)13-15-5-2-1-3-6-15/h1-7,12,16H,8-11,13-14,21H2,(H,22,27)