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

Systemtic Name: 1-cyclopentyl-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-cyclopentyl-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-cyclopentyl-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-cyclopentyl-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-cyclopentyl-1-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C24H35N4O2S+ MolecularWeight: 443.6253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCC3)C(=S)NCCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCC3)C(=S)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C24H34N4O2S/c1-18-7-8-22-19(15-18)16-20(23(29)26-22)17-28(21-5-2-3-6-21)24(31)25-9-4-10-27-11-13-30-14-12-27/h7-8,15-16,21H,2-6,9-14,17H2,1H3,(H,25,31)(H,26,29)/p+1