1-(2,3-dipyridin-2-ylquinoxalin-6-yl)-3-(3-oxidanylpropyl)thiourea

Systemtic Name: 1-(2,3-dipyridin-2-ylquinoxalin-6-yl)-3-(3-oxidanylpropyl)thiourea Openeye Name: 1-[2,3-bis(2-pyridyl)quinoxalin-6-yl]-3-(3-hydroxypropyl)thiourea CAS Name: 1-[2,3-bis(2-pyridinyl)-6-quinoxalinyl]-3-(3-hydroxypropyl)thiourea IUPAC Name: 1-(2,3-dipyridin-2-ylquinoxalin-6-yl)-3-(3-hydroxypropyl)thiourea Traditional Name: 1-[2,3-bis(2-pyridyl)quinoxalin-6-yl]-3-(3-hydroxypropyl)thiourea Formula: C22H20N6OS MolecularWeight: 416.4988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NC3=C(C=C(C=C3)NC(=S)NCCCO)N=C2C4=CC=CC=N4

Isomeric SMILES

C1=CC=NC(=C1)C2=NC3=C(C=C(C=C3)NC(=S)NCCCO)N=C2C4=CC=CC=N4

InChI

InChI=1S/C22H20N6OS/c29-13-5-12-25-22(30)26-15-8-9-16-19(14-15)28-21(18-7-2-4-11-24-18)20(27-16)17-6-1-3-10-23-17/h1-4,6-11,14,29H,5,12-13H2,(H2,25,26,30)