N-[4-[4-methyl-5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]phenyl]propanamide

Systemtic Name: N-[4-[4-methyl-5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-1,2,4-triazol-3-yl]phenyl]propanamide Openeye Name: N-[4-[4-methyl-5-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-1,2,4-triazol-3-yl]phenyl]propanamide CAS Name: N-[4-[4-methyl-5-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-1,2,4-triazol-3-yl]phenyl]propanamide IUPAC Name: N-[4-[4-methyl-5-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-1,2,4-triazol-3-yl]phenyl]propanamide Traditional Name: N-[4-[5-[(2-keto-2-piperidino-ethyl)thio]-4-methyl-1,2,4-triazol-3-yl]phenyl]propionamide Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)N3CCCCC3

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)N3CCCCC3

InChI

InChI=1S/C19H25N5O2S/c1-3-16(25)20-15-9-7-14(8-10-15)18-21-22-19(23(18)2)27-13-17(26)24-11-5-4-6-12-24/h7-10H,3-6,11-13H2,1-2H3,(H,20,25)