1-[(Z)-1-(4-methoxynaphthalen-1-yl)ethylideneamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-[(Z)-1-(4-methoxynaphthalen-1-yl)ethylideneamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-[(Z)-1-(4-methoxy-1-naphthyl)ethylideneamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-[(Z)-1-(4-methoxy-1-naphthalenyl)ethylideneamino]-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-[(Z)-1-(4-methoxynaphthalen-1-yl)ethylideneamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-[(Z)-1-(4-methoxy-1-naphthyl)ethylideneamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C21H29N4O2S+ MolecularWeight: 401.54556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCCC[NH+]1CCOCC1)C2=CC=C(C3=CC=CC=C32)OC

Isomeric SMILES

C/C(=N/NC(=S)NCCC[NH+]1CCOCC1)/C2=CC=C(C3=CC=CC=C32)OC

InChI

InChI=1S/C21H28N4O2S/c1-16(17-8-9-20(26-2)19-7-4-3-6-18(17)19)23-24-21(28)22-10-5-11-25-12-14-27-15-13-25/h3-4,6-9H,5,10-15H2,1-2H3,(H2,22,24,28)/p+1/b23-16-