3-[2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-4-methyl-benzamide

Systemtic Name: 3-[2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-4-methyl-benzamide Openeye Name: 3-[[2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-4-methyl-benzamide CAS Name: 3-[[2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-4-methylbenzamide IUPAC Name: 3-[[2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-4-methylbenzamide Traditional Name: 3-[[2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]acetyl]amino]-4-methyl-benzamide Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N)NC(=O)CSC2=NN=C(N2C3CCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N)NC(=O)CSC2=NN=C(N2C3CCCCC3)C

InChI

InChI=1S/C19H25N5O2S/c1-12-8-9-14(18(20)26)10-16(12)21-17(25)11-27-19-23-22-13(2)24(19)15-6-4-3-5-7-15/h8-10,15H,3-7,11H2,1-2H3,(H2,20,26)(H,21,25)