1-(3-oxidanylpropyl)-3-quinoxalino[2,3-f][4,7]phenanthrolin-11-yl-thiourea

Systemtic Name: 1-(3-oxidanylpropyl)-3-quinoxalino[2,3-f][4,7]phenanthrolin-11-yl-thiourea Openeye Name: 1-(3-hydroxypropyl)-3-quinoxalino[2,3-f][4,7]phenanthrolin-11-yl-thiourea CAS Name: 1-(3-hydroxypropyl)-3-(11-quinoxalino[2,3-f][4,7]phenanthrolinyl)thiourea IUPAC Name: 1-(3-hydroxypropyl)-3-quinoxalino[2,3-f][4,7]phenanthrolin-11-ylthiourea Traditional Name: 1-(3-hydroxypropyl)-3-quinoxalino[2,3-f][4,7]phenanthrolin-11-yl-thiourea Formula: C22H18N6OS MolecularWeight: 414.48292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C=CC=NC3=C4C(=C2N=C1)N=C5C=CC(=CC5=N4)NC(=S)NCCCO

Isomeric SMILES

C1=CC2=C3C=CC=NC3=C4C(=C2N=C1)N=C5C=CC(=CC5=N4)NC(=S)NCCCO

InChI

InChI=1S/C22H18N6OS/c29-11-3-10-25-22(30)26-13-6-7-16-17(12-13)28-21-19-15(5-2-9-24-19)14-4-1-8-23-18(14)20(21)27-16/h1-2,4-9,12,29H,3,10-11H2,(H2,25,26,30)