1-cyclohexyl-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-cyclohexyl-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-cyclohexyl-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-cyclohexyl-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-cyclohexyl-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-cyclohexyl-1-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C25H37N4O2S+ MolecularWeight: 457.65188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCCC3)C(=S)NCCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCCC3)C(=S)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C25H36N4O2S/c1-19-8-9-23-20(16-19)17-21(24(30)27-23)18-29(22-6-3-2-4-7-22)25(32)26-10-5-11-28-12-14-31-15-13-28/h8-9,16-17,22H,2-7,10-15,18H2,1H3,(H,26,32)(H,27,30)/p+1