(2R)-2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropyl-2-phenyl-ethanamide

Systemtic Name: (2R)-2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropyl-2-phenyl-ethanamide Openeye Name: (2R)-2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropyl-2-phenyl-acetamide CAS Name: (2R)-2-[[4-amino-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-cyclopropyl-2-phenylacetamide IUPAC Name: (2R)-2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropyl-2-phenylacetamide Traditional Name: (2R)-2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-cyclopropyl-2-phenyl-acetamide Formula: C18H18N6OS MolecularWeight: 366.44012

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(C2=CC=CC=C2)SC3=NN=C(N3N)C4=CN=CC=C4

Isomeric SMILES

C1CC1NC(=O)[C@@H](C2=CC=CC=C2)SC3=NN=C(N3N)C4=CN=CC=C4

InChI

InChI=1S/C18H18N6OS/c19-24-16(13-7-4-10-20-11-13)22-23-18(24)26-15(12-5-2-1-3-6-12)17(25)21-14-8-9-14/h1-7,10-11,14-15H,8-9,19H2,(H,21,25)/t15-/m1/s1