2-[[4-(furan-2-ylmethyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)propanamide

Systemtic Name: 2-[[4-(furan-2-ylmethyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)propanamide Openeye Name: 2-[[4-(2-furylmethyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)propanamide CAS Name: 2-[[4-(2-furanylmethyl)-5-(1-pyrrolidinyl)-1,2,4-triazol-3-yl]thio]-N-(4-methoxyphenyl)propanamide IUPAC Name: 2-[[4-(furan-2-ylmethyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)propanamide Traditional Name: 2-[[4-(2-furfuryl)-5-pyrrolidino-1,2,4-triazol-3-yl]thio]-N-(4-methoxyphenyl)propionamide Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC)SC2=NN=C(N2CC3=CC=CO3)N4CCCC4

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)OC)SC2=NN=C(N2CC3=CC=CO3)N4CCCC4

InChI

InChI=1S/C21H25N5O3S/c1-15(19(27)22-16-7-9-17(28-2)10-8-16)30-21-24-23-20(25-11-3-4-12-25)26(21)14-18-6-5-13-29-18/h5-10,13,15H,3-4,11-12,14H2,1-2H3,(H,22,27)