1-[1-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-[1-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-[1-(3-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)ethylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-[1-(3-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)ethylamino]-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-[1-(3-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)ethylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-[1-(6-keto-3-methyl-cyclohexa-2,4-dien-1-ylidene)ethylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C17H27N4O2S+ MolecularWeight: 351.48688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C)NNC(=S)NCCC[NH+]2CCOCC2)C(=O)C=C1

Isomeric SMILES

CC1=CC(=C(C)NNC(=S)NCCC[NH+]2CCOCC2)C(=O)C=C1

InChI

InChI=1S/C17H26N4O2S/c1-13-4-5-16(22)15(12-13)14(2)19-20-17(24)18-6-3-7-21-8-10-23-11-9-21/h4-5,12,19H,3,6-11H2,1-2H3,(H2,18,20,24)/p+1