1-(2-morpholin-4-ium-4-ylethyl)-3-[(Z)-(2-prop-2-ynoxynaphthalen-1-yl)methylideneamino]thiourea

Systemtic Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-[(Z)-(2-prop-2-ynoxynaphthalen-1-yl)methylideneamino]thiourea Openeye Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-[(Z)-(2-prop-2-ynoxy-1-naphthyl)methyleneamino]thiourea CAS Name: 1-[2-(4-morpholin-4-iumyl)ethyl]-3-[(Z)-(2-prop-2-ynoxy-1-naphthalenyl)methylideneamino]thiourea IUPAC Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-[(Z)-(2-prop-2-ynoxynaphthalen-1-yl)methylideneamino]thiourea Traditional Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-[(Z)-(2-propargyloxy-1-naphthyl)methyleneamino]thiourea Formula: C21H25N4O2S+ MolecularWeight: 397.5138

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=C(C2=CC=CC=C2C=C1)C=NNC(=S)NCC[NH+]3CCOCC3

Isomeric SMILES

C#CCOC1=C(C2=CC=CC=C2C=C1)/C=N\NC(=S)NCC[NH+]3CCOCC3

InChI

InChI=1S/C21H24N4O2S/c1-2-13-27-20-8-7-17-5-3-4-6-18(17)19(20)16-23-24-21(28)22-9-10-25-11-14-26-15-12-25/h1,3-8,16H,9-15H2,(H2,22,24,28)/p+1/b23-16-