1-[(7-chloranyl-6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-ethyl-1-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-[(7-chloranyl-6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-ethyl-1-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[(7-chloro-6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-ethyl-1-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[(7-chloro-6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-ethyl-1-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[(7-chloro-6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-ethyl-1-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[(7-chloro-2-keto-6-methyl-1H-quinolin-3-yl)methyl]-3-ethyl-1-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C20H28ClN4O2S+ MolecularWeight: 423.97992

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N(CC[NH+]1CCOCC1)CC2=CC3=CC(=C(C=C3NC2=O)Cl)C

Isomeric SMILES

CCNC(=S)N(CC[NH+]1CCOCC1)CC2=CC3=CC(=C(C=C3NC2=O)Cl)C

InChI

InChI=1S/C20H27ClN4O2S/c1-3-22-20(28)25(5-4-24-6-8-27-9-7-24)13-16-11-15-10-14(2)17(21)12-18(15)23-19(16)26/h10-12H,3-9,13H2,1-2H3,(H,22,28)(H,23,26)/p+1