N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-4-yl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-4-yl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-[1-(2-anilino-2-oxo-ethyl)-4-piperidyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[1-(2-anilino-2-oxoethyl)-4-piperidinyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-[1-(2-anilino-2-keto-ethyl)-4-piperidyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C22H26N6O2S2 MolecularWeight: 470.61084

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)CCN2C(=NNC2=S)C3=CC=CS3)CC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC(=O)CCN2C(=NNC2=S)C3=CC=CS3)CC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H26N6O2S2/c29-19(10-13-28-21(25-26-22(28)31)18-7-4-14-32-18)23-17-8-11-27(12-9-17)15-20(30)24-16-5-2-1-3-6-16/h1-7,14,17H,8-13,15H2,(H,23,29)(H,24,30)(H,26,31)