1-[(Z)-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)methylideneamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-[(Z)-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)methylideneamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-[(Z)-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)methyleneamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-[(Z)-(1-cyclohexyl-2,5-dimethyl-3-pyrrolyl)methylideneamino]-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-[(Z)-(1-cyclohexyl-2,5-dimethylpyrrol-3-yl)methylideneamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-[(Z)-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)methyleneamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C21H36N5OS+ MolecularWeight: 406.60844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CCCCC2)C)C=NNC(=S)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1=CC(=C(N1C2CCCCC2)C)/C=N\NC(=S)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C21H35N5OS/c1-17-15-19(18(2)26(17)20-7-4-3-5-8-20)16-23-24-21(28)22-9-6-10-25-11-13-27-14-12-25/h15-16,20H,3-14H2,1-2H3,(H2,22,24,28)/p+1/b23-16-