methyl N-[(2R)-2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]carbamate

Systemtic Name: methyl N-[(2R)-2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]carbamate Openeye Name: methyl N-[(2R)-2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propanoyl]carbamate CAS Name: N-[(2R)-2-[[4-cyclopropyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-1-oxopropyl]carbamic acid methyl ester IUPAC Name: methyl N-[(2R)-2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]carbamate Traditional Name: N-[(2R)-2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]propanoyl]carbamic acid methyl ester Formula: C15H17N5O3S MolecularWeight: 347.39218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)OC)SC1=NN=C(N1C2CC2)C3=CN=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC(=O)OC)SC1=NN=C(N1C2CC2)C3=CN=CC=C3

InChI

InChI=1S/C15H17N5O3S/c1-9(13(21)17-15(22)23-2)24-14-19-18-12(20(14)11-5-6-11)10-4-3-7-16-8-10/h3-4,7-9,11H,5-6H2,1-2H3,(H,17,21,22)/t9-/m1/s1