3-[4-methyl-5-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylphenyl)amino]ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-methyl-5-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylphenyl)amino]ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-methyl-5-[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-methyl-5-[[2-oxo-2-[4-(1-pyrrolidinyl)anilino]ethyl]thio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-methyl-5-[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[[2-keto-2-(4-pyrrolidinoanilino)ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C18H24N6O2S MolecularWeight: 388.48716

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)N3CCCC3)CCC(=O)N

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)N3CCCC3)CCC(=O)N

InChI

InChI=1S/C18H24N6O2S/c1-23-16(9-8-15(19)25)21-22-18(23)27-12-17(26)20-13-4-6-14(7-5-13)24-10-2-3-11-24/h4-7H,2-3,8-12H2,1H3,(H2,19,25)(H,20,26)