1-[2-(cyclohexen-1-yl)ethyl]-3-(1,10-phenanthrolin-5-yl)thiourea

Systemtic Name: 1-[2-(cyclohexen-1-yl)ethyl]-3-(1,10-phenanthrolin-5-yl)thiourea Openeye Name: 1-[2-(cyclohexen-1-yl)ethyl]-3-(1,10-phenanthrolin-5-yl)thiourea CAS Name: 1-[2-(1-cyclohexenyl)ethyl]-3-(1,10-phenanthrolin-5-yl)thiourea IUPAC Name: 1-[2-(cyclohexen-1-yl)ethyl]-3-(1,10-phenanthrolin-5-yl)thiourea Traditional Name: 1-[2-(cyclohexen-1-yl)ethyl]-3-(1,10-phenanthrolin-5-yl)thiourea Formula: C21H22N4S MolecularWeight: 362.49118

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=S)NC2=C3C=CC=NC3=C4C(=C2)C=CC=N4

Isomeric SMILES

C1CCC(=CC1)CCNC(=S)NC2=C3C=CC=NC3=C4C(=C2)C=CC=N4

InChI

InChI=1S/C21H22N4S/c26-21(24-13-10-15-6-2-1-3-7-15)25-18-14-16-8-4-11-22-19(16)20-17(18)9-5-12-23-20/h4-6,8-9,11-12,14H,1-3,7,10,13H2,(H2,24,25,26)