(2R)-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(propan-2-ylcarbamoyl)propanamide

Systemtic Name: (2R)-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(propan-2-ylcarbamoyl)propanamide Openeye Name: (2R)-2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(isopropylcarbamoyl)propanamide CAS Name: (2R)-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-N-[oxo-(propan-2-ylamino)methyl]propanamide IUPAC Name: (2R)-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(propan-2-ylcarbamoyl)propanamide Traditional Name: (2R)-2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(isopropylcarbamoyl)propionamide Formula: C17H22N6O2S MolecularWeight: 374.46058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N6O2S/c1-10(2)19-16(25)20-15(24)11(3)26-17-22-21-14(23(17)13-4-5-13)12-6-8-18-9-7-12/h6-11,13H,4-5H2,1-3H3,(H2,19,20,24,25)/t11-/m1/s1