1-[2-(cyclohexen-1-yl)ethyl]-3-(4,7-phenanthrolin-5-yl)urea

Systemtic Name: 1-[2-(cyclohexen-1-yl)ethyl]-3-(4,7-phenanthrolin-5-yl)urea Openeye Name: 1-[2-(cyclohexen-1-yl)ethyl]-3-(4,7-phenanthrolin-5-yl)urea CAS Name: 1-[2-(1-cyclohexenyl)ethyl]-3-(4,7-phenanthrolin-5-yl)urea IUPAC Name: 1-[2-(cyclohexen-1-yl)ethyl]-3-(4,7-phenanthrolin-5-yl)urea Traditional Name: 1-[2-(cyclohexen-1-yl)ethyl]-3-(4,7-phenanthrolin-5-yl)urea Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=O)NC2=C3C(=C4C=CC=NC4=C2)C=CC=N3

Isomeric SMILES

C1CCC(=CC1)CCNC(=O)NC2=C3C(=C4C=CC=NC4=C2)C=CC=N3

InChI

InChI=1S/C21H22N4O/c26-21(24-13-10-15-6-2-1-3-7-15)25-19-14-18-16(8-4-11-22-18)17-9-5-12-23-20(17)19/h4-6,8-9,11-12,14H,1-3,7,10,13H2,(H2,24,25,26)