3-[5-oxidanylidene-2-(thiophen-2-ylmethyl)pyrrolidin-2-yl]-N-[(2-phenyl-1,2,3-triazol-4-yl)methyl]propanamide

Systemtic Name: 3-[5-oxidanylidene-2-(thiophen-2-ylmethyl)pyrrolidin-2-yl]-N-[(2-phenyl-1,2,3-triazol-4-yl)methyl]propanamide Openeye Name: 3-[5-oxo-2-(2-thienylmethyl)pyrrolidin-2-yl]-N-[(2-phenyltriazol-4-yl)methyl]propanamide CAS Name: 3-[5-oxo-2-(thiophen-2-ylmethyl)-2-pyrrolidinyl]-N-[(2-phenyl-4-triazolyl)methyl]propanamide IUPAC Name: 3-[5-oxo-2-(thiophen-2-ylmethyl)pyrrolidin-2-yl]-N-[(2-phenyltriazol-4-yl)methyl]propanamide Traditional Name: 3-[5-keto-2-(2-thenyl)pyrrolidin-2-yl]-N-[(2-phenyltriazol-4-yl)methyl]propionamide Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1=O)(CCC(=O)NCC2=NN(N=C2)C3=CC=CC=C3)CC4=CC=CS4

Isomeric SMILES

C1CC(NC1=O)(CCC(=O)NCC2=NN(N=C2)C3=CC=CC=C3)CC4=CC=CS4

InChI

InChI=1S/C21H23N5O2S/c27-19(22-14-16-15-23-26(25-16)17-5-2-1-3-6-17)8-10-21(11-9-20(28)24-21)13-18-7-4-12-29-18/h1-7,12,15H,8-11,13-14H2,(H,22,27)(H,24,28)