1-[(4-methyl-2-phenyl-1,3-thiazol-5-yl)carbonylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-[(4-methyl-2-phenyl-1,3-thiazol-5-yl)carbonylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-[(4-methyl-2-phenyl-thiazole-5-carbonyl)amino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-[[(4-methyl-2-phenyl-5-thiazolyl)-oxomethyl]amino]-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-[(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)amino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-[(4-methyl-2-phenyl-thiazole-5-carbonyl)amino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C19H26N5O2S2+ MolecularWeight: 420.57204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)NNC(=S)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)NNC(=S)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C19H25N5O2S2/c1-14-16(28-18(21-14)15-6-3-2-4-7-15)17(25)22-23-19(27)20-8-5-9-24-10-12-26-13-11-24/h2-4,6-7H,5,8-13H2,1H3,(H,22,25)(H2,20,23,27)/p+1