1-(3-morpholin-4-ium-4-ylpropyl)-3-[(Z)-(2-propoxynaphthalen-1-yl)methylideneamino]thiourea

Systemtic Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(Z)-(2-propoxynaphthalen-1-yl)methylideneamino]thiourea Openeye Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(Z)-(2-propoxy-1-naphthyl)methyleneamino]thiourea CAS Name: 1-[3-(4-morpholin-4-iumyl)propyl]-3-[(Z)-(2-propoxy-1-naphthalenyl)methylideneamino]thiourea IUPAC Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(Z)-(2-propoxynaphthalen-1-yl)methylideneamino]thiourea Traditional Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(Z)-(2-propoxy-1-naphthyl)methyleneamino]thiourea Formula: C22H31N4O2S+ MolecularWeight: 415.57214

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C2=CC=CC=C2C=C1)C=NNC(=S)NCCC[NH+]3CCOCC3

Isomeric SMILES

CCCOC1=C(C2=CC=CC=C2C=C1)/C=N\NC(=S)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C22H30N4O2S/c1-2-14-28-21-9-8-18-6-3-4-7-19(18)20(21)17-24-25-22(29)23-10-5-11-26-12-15-27-16-13-26/h3-4,6-9,17H,2,5,10-16H2,1H3,(H2,23,25,29)/p+1/b24-17-