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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(N1N)SCC(=O)NC2=NC(=C(S2)C(=O)OC(C)C)C

Isomeric SMILES

CCCCC1=NN=C(N1N)SCC(=O)NC2=NC(=C(S2)C(=O)OC(C)C)C

InChI

InChI=1S/C16H24N6O3S2/c1-5-6-7-11-20-21-16(22(11)17)26-8-12(23)19-15-18-10(4)13(27-15)14(24)25-9(2)3/h9H,5-8,17H2,1-4H3,(H,18,19,23)