1-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C16H23N4O3S+ MolecularWeight: 351.44382

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCC[NH+]1CCOCC1)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C/C(=N/NC(=S)NCC[NH+]1CCOCC1)/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H22N4O3S/c1-12(13-2-3-14-15(10-13)23-11-22-14)18-19-16(24)17-4-5-20-6-8-21-9-7-20/h2-3,10H,4-9,11H2,1H3,(H2,17,19,24)/p+1/b18-12-