1-[(Z)-(4-methyl-3-nitro-phenyl)methylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-[(Z)-(4-methyl-3-nitro-phenyl)methylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[(Z)-(4-methyl-3-nitro-phenyl)methyleneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[(Z)-(4-methyl-3-nitrophenyl)methylideneamino]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[(Z)-(4-methyl-3-nitrophenyl)methylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[(Z)-(4-methyl-3-nitro-benzylidene)amino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C15H22N5O3S+ MolecularWeight: 352.43188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C=NNC(=S)NCC[NH+]2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)/C=N\NC(=S)NCC[NH+]2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C15H21N5O3S/c1-12-2-3-13(10-14(12)20(21)22)11-17-18-15(24)16-4-5-19-6-8-23-9-7-19/h2-3,10-11H,4-9H2,1H3,(H2,16,18,24)/p+1/b17-11-