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

Systemtic Name: 2-methylpropyl 2-[2-[(4-azanyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: isobutyl 2-[[2-[(4-amino-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-[(4-amino-5-propan-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-4-methyl-5-thiazolecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[[2-[(4-amino-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[(4-amino-5-isopropyl-1,2,4-triazol-3-yl)thio]acetyl]amino]-4-methyl-thiazole-5-carboxylic acid isobutyl ester Formula: C16H24N6O3S2 MolecularWeight: 412.53016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N6O3S2/c1-8(2)6-25-14(24)12-10(5)18-15(27-12)19-11(23)7-26-16-21-20-13(9(3)4)22(16)17/h8-9H,6-7,17H2,1-5H3,(H,18,19,23)