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

Systemtic Name: 1-[(Z)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[(Z)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[(Z)-1-(4-methyl-3-nitrophenyl)ethylideneamino]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[(Z)-1-(4-methyl-3-nitrophenyl)ethylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[(Z)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C16H24N5O3S+ MolecularWeight: 366.45846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N5O3S/c1-12-3-4-14(11-15(12)21(22)23)13(2)18-19-16(25)17-5-6-20-7-9-24-10-8-20/h3-4,11H,5-10H2,1-2H3,(H2,17,19,25)/p+1/b18-13-