1-butyl-3-[(Z)-1-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]ethylideneamino]thiourea

Systemtic Name: 1-butyl-3-[(Z)-1-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]ethylideneamino]thiourea Openeye Name: 1-butyl-3-[(Z)-1-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]ethylideneamino]thiourea CAS Name: 1-butyl-3-[(Z)-1-[4-methoxy-3-(4-morpholin-4-iumylmethyl)phenyl]ethylideneamino]thiourea IUPAC Name: 1-butyl-3-[(Z)-1-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]ethylideneamino]thiourea Traditional Name: 1-butyl-3-[(Z)-1-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]ethylideneamino]thiourea Formula: C19H31N4O2S+ MolecularWeight: 379.54004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=C(C)C1=CC(=C(C=C1)OC)C[NH+]2CCOCC2

Isomeric SMILES

CCCCNC(=S)N/N=C(/C)\C1=CC(=C(C=C1)OC)C[NH+]2CCOCC2

InChI

InChI=1S/C19H30N4O2S/c1-4-5-8-20-19(26)22-21-15(2)16-6-7-18(24-3)17(13-16)14-23-9-11-25-12-10-23/h6-7,13H,4-5,8-12,14H2,1-3H3,(H2,20,22,26)/p+1/b21-15-