1-[(2-morpholin-4-yl-1,3-thiazol-4-yl)carbonylamino]-3-[1-(phenylmethyl)piperidin-1-ium-4-yl]urea

Systemtic Name: 1-[(2-morpholin-4-yl-1,3-thiazol-4-yl)carbonylamino]-3-[1-(phenylmethyl)piperidin-1-ium-4-yl]urea Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-[(2-morpholinothiazole-4-carbonyl)amino]urea CAS Name: 1-[[[2-(4-morpholinyl)-4-thiazolyl]-oxomethyl]amino]-3-[1-(phenylmethyl)-4-piperidin-1-iumyl]urea IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-[(2-morpholin-4-yl-1,3-thiazole-4-carbonyl)amino]urea Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-[(2-morpholinothiazole-4-carbonyl)amino]urea Formula: C21H29N6O3S+ MolecularWeight: 445.55836

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)NNC(=O)C2=CSC(=N2)N3CCOCC3)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)NNC(=O)C2=CSC(=N2)N3CCOCC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H28N6O3S/c28-19(18-15-31-21(23-18)27-10-12-30-13-11-27)24-25-20(29)22-17-6-8-26(9-7-17)14-16-4-2-1-3-5-16/h1-5,15,17H,6-14H2,(H,24,28)(H2,22,25,29)/p+1