1-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[(2,5-dimethyl-3-pyrrolylidene)methylamino]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[(2,5-dimethylpyrrol-3-ylidene)methylamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C14H24N5OS+ MolecularWeight: 310.43826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNNC(=S)NCC[NH+]2CCOCC2)C(=N1)C

Isomeric SMILES

CC1=CC(=CNNC(=S)NCC[NH+]2CCOCC2)C(=N1)C

InChI

InChI=1S/C14H23N5OS/c1-11-9-13(12(2)17-11)10-16-18-14(21)15-3-4-19-5-7-20-8-6-19/h9-10,16H,3-8H2,1-2H3,(H2,15,18,21)/p+1