2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(2,3-dihydroindol-1-yl)propan-1-one

Systemtic Name: 2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(2,3-dihydroindol-1-yl)propan-1-one Openeye Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1-indolin-1-yl-propan-1-one CAS Name: 2-[[4-amino-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-1-(2,3-dihydroindol-1-yl)-1-propanone IUPAC Name: 2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(2,3-dihydroindol-1-yl)propan-1-one Traditional Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-1-indolin-1-yl-propan-1-one Formula: C18H18N6OS MolecularWeight: 366.44012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)SC3=NN=C(N3N)C4=CN=CC=C4

Isomeric SMILES

CC(C(=O)N1CCC2=CC=CC=C21)SC3=NN=C(N3N)C4=CN=CC=C4

InChI

InChI=1S/C18H18N6OS/c1-12(17(25)23-10-8-13-5-2-3-7-15(13)23)26-18-22-21-16(24(18)19)14-6-4-9-20-11-14/h2-7,9,11-12H,8,10,19H2,1H3