3-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)benzamide

Systemtic Name: 3-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)benzamide Openeye Name: 3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)benzamide CAS Name: 3-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-N-[2-phenyl-2-(1-pyrrolidinyl)ethyl]benzamide IUPAC Name: 3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide Traditional Name: 3-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetyl]amino]-N-(2-phenyl-2-pyrrolidino-ethyl)benzamide Formula: C24H28N6O2S MolecularWeight: 464.58312

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)NCC(C3=CC=CC=C3)N4CCCC4

Isomeric SMILES

CN1C=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)NCC(C3=CC=CC=C3)N4CCCC4

InChI

InChI=1S/C24H28N6O2S/c1-29-17-26-28-24(29)33-16-22(31)27-20-11-7-10-19(14-20)23(32)25-15-21(30-12-5-6-13-30)18-8-3-2-4-9-18/h2-4,7-11,14,17,21H,5-6,12-13,15-16H2,1H3,(H,25,32)(H,27,31)