N-[2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-4-tert-butyl-benzamide

Systemtic Name: N-[2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-4-tert-butyl-benzamide Openeye Name: N-[2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4-tert-butyl-benzamide CAS Name: N-[2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-4-tert-butylbenzamide IUPAC Name: N-[2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4-tert-butylbenzamide Traditional Name: N-[2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]acetyl]-4-tert-butyl-benzamide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1N)SCC(=O)NC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=NN=C(N1N)SCC(=O)NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C16H21N5O2S/c1-10-19-20-15(21(10)17)24-9-13(22)18-14(23)11-5-7-12(8-6-11)16(2,3)4/h5-8H,9,17H2,1-4H3,(H,18,22,23)