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

Systemtic Name: N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-[2-(benzylamino)-2-oxo-ethyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[2-oxo-2-[(phenylmethyl)amino]ethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-[2-(benzylamino)-2-oxoethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-[2-(benzylamino)-2-keto-ethyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C18H19N5O2S2 MolecularWeight: 401.50576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CNC(=O)CCN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CNC(=O)CCN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C18H19N5O2S2/c24-15(20-12-16(25)19-11-13-5-2-1-3-6-13)8-9-23-17(21-22-18(23)26)14-7-4-10-27-14/h1-7,10H,8-9,11-12H2,(H,19,25)(H,20,24)(H,22,26)