2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-N-[(3-nitrophenyl)methyl]ethanamide

Systemtic Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-N-[(3-nitrophenyl)methyl]ethanamide Openeye Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-N-[(3-nitrophenyl)methyl]acetamide CAS Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-methyl-N-[(3-nitrophenyl)methyl]acetamide IUPAC Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-N-[(3-nitrophenyl)methyl]acetamide Traditional Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-methyl-N-(3-nitrobenzyl)acetamide Formula: C24H21N5O3S MolecularWeight: 459.52024

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H21N5O3S/c1-27(16-18-9-8-14-21(15-18)29(31)32)22(30)17-33-24-26-25-23(19-10-4-2-5-11-19)28(24)20-12-6-3-7-13-20/h2-15H,16-17H2,1H3