(2S)-2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-propan-2-ylpyrazol-3-yl)propanamide

Systemtic Name: (2S)-2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-propan-2-ylpyrazol-3-yl)propanamide Openeye Name: (2S)-2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-isopropylpyrazol-3-yl)propanamide CAS Name: (2S)-2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-(2-propan-2-yl-3-pyrazolyl)propanamide IUPAC Name: (2S)-2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-propan-2-ylpyrazol-3-yl)propanamide Traditional Name: (2S)-2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-(2-isopropylpyrazol-3-yl)propionamide Formula: C14H21N7OS MolecularWeight: 335.42784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CC=N1)NC(=O)C(C)SC2=NN=C(N2N)C3CC3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=NN1C(C)C)SC2=NN=C(N2N)C3CC3

InChI

InChI=1S/C14H21N7OS/c1-8(2)21-11(6-7-16-21)17-13(22)9(3)23-14-19-18-12(20(14)15)10-4-5-10/h6-10H,4-5,15H2,1-3H3,(H,17,22)/t9-/m0/s1