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

Systemtic Name: 1-[(Z)-(4-bromanyl-3-nitro-phenyl)methylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[(Z)-(4-bromo-3-nitro-phenyl)methyleneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[(Z)-(4-bromo-3-nitrophenyl)methylideneamino]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[(Z)-(4-bromo-3-nitrophenyl)methylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[(Z)-(4-bromo-3-nitro-benzylidene)amino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C14H19BrN5O3S+ MolecularWeight: 417.30136

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)NN=CC2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)N/N=C\C2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C14H18BrN5O3S/c15-12-2-1-11(9-13(12)20(21)22)10-17-18-14(24)16-3-4-19-5-7-23-8-6-19/h1-2,9-10H,3-8H2,(H2,16,18,24)/p+1/b17-10-