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

Systemtic Name: 3-[4-cyclopropyl-5-[2-oxidanylidene-2-(1-thiophen-2-ylethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-cyclopropyl-5-[2-oxo-2-[1-(2-thienyl)ethylamino]ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-cyclopropyl-5-[[2-oxo-2-(1-thiophen-2-ylethylamino)ethyl]thio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-cyclopropyl-5-[2-oxo-2-(1-thiophen-2-ylethylamino)ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-cyclopropyl-5-[[2-keto-2-[1-(2-thienyl)ethylamino]ethyl]thio]-1,2,4-triazol-3-yl]propionamide Formula: C16H21N5O2S2 MolecularWeight: 379.50024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC(=O)CSC2=NN=C(N2C3CC3)CCC(=O)N

Isomeric SMILES

CC(C1=CC=CS1)NC(=O)CSC2=NN=C(N2C3CC3)CCC(=O)N

InChI

InChI=1S/C16H21N5O2S2/c1-10(12-3-2-8-24-12)18-15(23)9-25-16-20-19-14(7-6-13(17)22)21(16)11-4-5-11/h2-3,8,10-11H,4-7,9H2,1H3,(H2,17,22)(H,18,23)