1-[(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-[(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[(3-chloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[(3-chloro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[(3-chloro-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C14H20ClN4O2S+ MolecularWeight: 343.8522

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)NNC=C2C=C(C=CC2=O)Cl

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)NNC=C2C=C(C=CC2=O)Cl

InChI

InChI=1S/C14H19ClN4O2S/c15-12-1-2-13(20)11(9-12)10-17-18-14(22)16-3-4-19-5-7-21-8-6-19/h1-2,9-10,17H,3-8H2,(H2,16,18,22)/p+1