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

Systemtic Name: 1-[(3-chloranyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[(3-chloro-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[(3-chloro-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[(3-chloro-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[(3-chloro-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C15H22ClN4O3S+ MolecularWeight: 373.87818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC(=S)NCC[NH+]2CCOCC2)C=C(C1=O)Cl

Isomeric SMILES

COC1=CC(=CNNC(=S)NCC[NH+]2CCOCC2)C=C(C1=O)Cl

InChI

InChI=1S/C15H21ClN4O3S/c1-22-13-9-11(8-12(16)14(13)21)10-18-19-15(24)17-2-3-20-4-6-23-7-5-20/h8-10,18H,2-7H2,1H3,(H2,17,19,24)/p+1