1-[(3-chloranyl-5-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-[(3-chloranyl-5-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-[(3-chloro-5-ethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-[(3-chloro-5-ethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-[(3-chloro-5-ethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-[(3-chloro-5-ethoxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C17H26ClN4O3S+ MolecularWeight: 401.93134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNNC(=S)NCCC[NH+]2CCOCC2)C=C(C1=O)Cl

Isomeric SMILES

CCOC1=CC(=CNNC(=S)NCCC[NH+]2CCOCC2)C=C(C1=O)Cl

InChI

InChI=1S/C17H25ClN4O3S/c1-2-25-15-11-13(10-14(18)16(15)23)12-20-21-17(26)19-4-3-5-22-6-8-24-9-7-22/h10-12,20H,2-9H2,1H3,(H2,19,21,26)/p+1