2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(7-ethyl-1H-indol-3-yl)-2-phenyl-ethanone

Systemtic Name: 2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(7-ethyl-1H-indol-3-yl)-2-phenyl-ethanone Openeye Name: 2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(7-ethyl-1H-indol-3-yl)-2-phenyl-ethanone CAS Name: 2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1-(7-ethyl-1H-indol-3-yl)-2-phenylethanone IUPAC Name: 2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(7-ethyl-1H-indol-3-yl)-2-phenylethanone Traditional Name: 2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-1-(7-ethyl-1H-indol-3-yl)-2-phenyl-ethanone Formula: C28H25N5OS MolecularWeight: 479.596

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)C(C3=CC=CC=C3)SC4=NN=C(N4C5CC5)C6=CC=NC=C6

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)C(C3=CC=CC=C3)SC4=NN=C(N4C5CC5)C6=CC=NC=C6

InChI

InChI=1S/C28H25N5OS/c1-2-18-9-6-10-22-23(17-30-24(18)22)25(34)26(19-7-4-3-5-8-19)35-28-32-31-27(33(28)21-11-12-21)20-13-15-29-16-14-20/h3-10,13-17,21,26,30H,2,11-12H2,1H3