1-ethyl-3-(2-morpholin-4-ium-4-ylethyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]thiourea

Systemtic Name: 1-ethyl-3-(2-morpholin-4-ium-4-ylethyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]thiourea Openeye Name: 1-ethyl-3-(2-morpholin-4-ium-4-ylethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea CAS Name: 1-ethyl-3-[2-(4-morpholin-4-iumyl)ethyl]-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea IUPAC Name: 1-ethyl-3-(2-morpholin-4-ium-4-ylethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea Traditional Name: 1-ethyl-1-[(4-keto-1H-quinazolin-2-yl)methyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C18H26N5O2S+ MolecularWeight: 376.49634

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=S)NCC[NH+]3CCOCC3

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=S)NCC[NH+]3CCOCC3

InChI

InChI=1S/C18H25N5O2S/c1-2-23(18(26)19-7-8-22-9-11-25-12-10-22)13-16-20-15-6-4-3-5-14(15)17(24)21-16/h3-6H,2,7-13H2,1H3,(H,19,26)(H,20,21,24)/p+1