1-[2-(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-[2-(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[2-(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[2-(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[2-(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[2-(2-keto-5,8-dimethyl-1H-quinolin-3-yl)ethyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C20H29N4O2S+ MolecularWeight: 389.53486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CCNC(=S)NCC[NH+]3CCOCC3

Isomeric SMILES

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CCNC(=S)NCC[NH+]3CCOCC3

InChI

InChI=1S/C20H28N4O2S/c1-14-3-4-15(2)18-17(14)13-16(19(25)23-18)5-6-21-20(27)22-7-8-24-9-11-26-12-10-24/h3-4,13H,5-12H2,1-2H3,(H,23,25)(H2,21,22,27)/p+1