propan-2-yl 2-[2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: propan-2-yl 2-[2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: isopropyl 2-[[2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-4-methyl-5-thiazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]acetyl]amino]-4-methyl-thiazole-5-carboxylic acid isopropyl ester Formula: C18H26N6O3S2 MolecularWeight: 438.56744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CSC2=NN=C(N2N)C3CCCCC3)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CSC2=NN=C(N2N)C3CCCCC3)C(=O)OC(C)C

InChI

InChI=1S/C18H26N6O3S2/c1-10(2)27-16(26)14-11(3)20-17(29-14)21-13(25)9-28-18-23-22-15(24(18)19)12-7-5-4-6-8-12/h10,12H,4-9,19H2,1-3H3,(H,20,21,25)