3-[3-cyclopropyl-5-[2-oxidanylidene-2-(2-thiophen-2-ylethylcarbamoylamino)ethyl]sulfanyl-1,2,4-triazol-4-yl]propanamide

Systemtic Name: 3-[3-cyclopropyl-5-[2-oxidanylidene-2-(2-thiophen-2-ylethylcarbamoylamino)ethyl]sulfanyl-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-cyclopropyl-5-[2-oxo-2-[2-(2-thienyl)ethylcarbamoylamino]ethyl]sulfanyl-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-cyclopropyl-5-[[2-oxo-2-[[oxo-(2-thiophen-2-ylethylamino)methyl]amino]ethyl]thio]-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-cyclopropyl-5-[2-oxo-2-(2-thiophen-2-ylethylcarbamoylamino)ethyl]sulfanyl-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-cyclopropyl-5-[[2-keto-2-[2-(2-thienyl)ethylcarbamoylamino]ethyl]thio]-1,2,4-triazol-4-yl]propionamide Formula: C17H22N6O3S2 MolecularWeight: 422.52498

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2CCC(=O)N)SCC(=O)NC(=O)NCCC3=CC=CS3

Isomeric SMILES

C1CC1C2=NN=C(N2CCC(=O)N)SCC(=O)NC(=O)NCCC3=CC=CS3

InChI

InChI=1S/C17H22N6O3S2/c18-13(24)6-8-23-15(11-3-4-11)21-22-17(23)28-10-14(25)20-16(26)19-7-5-12-2-1-9-27-12/h1-2,9,11H,3-8,10H2,(H2,18,24)(H2,19,20,25,26)