[5-(1H-indol-5-ylmethylamino)-3-pyridin-3-yl-1,2,4-triazol-1-yl]-phenyl-methanone

Systemtic Name: [5-(1H-indol-5-ylmethylamino)-3-pyridin-3-yl-1,2,4-triazol-1-yl]-phenyl-methanone Openeye Name: [5-(1H-indol-5-ylmethylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-phenyl-methanone CAS Name: [5-(1H-indol-5-ylmethylamino)-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-phenylmethanone IUPAC Name: [5-(1H-indol-5-ylmethylamino)-3-pyridin-3-yl-1,2,4-triazol-1-yl]-phenylmethanone Traditional Name: [5-(1H-indol-5-ylmethylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-phenyl-methanone Formula: C23H18N6O MolecularWeight: 394.42862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)N2C(=NC(=N2)C3=CN=CC=C3)NCC4=CC5=C(C=C4)NC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N2C(=NC(=N2)C3=CN=CC=C3)NCC4=CC5=C(C=C4)NC=C5

InChI

InChI=1S/C23H18N6O/c30-22(17-5-2-1-3-6-17)29-23(27-21(28-29)19-7-4-11-24-15-19)26-14-16-8-9-20-18(13-16)10-12-25-20/h1-13,15,25H,14H2,(H,26,27,28)