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

Systemtic Name: 1-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[[4-(2-methylthiazol-4-yl)phenyl]methyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[[4-(2-methyl-4-thiazolyl)phenyl]methyl]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[4-(2-methylthiazol-4-yl)benzyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C18H25N4OS2+ MolecularWeight: 377.5473

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)CNC(=S)NCC[NH+]3CCOCC3

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)CNC(=S)NCC[NH+]3CCOCC3

InChI

InChI=1S/C18H24N4OS2/c1-14-21-17(13-25-14)16-4-2-15(3-5-16)12-20-18(24)19-6-7-22-8-10-23-11-9-22/h2-5,13H,6-12H2,1H3,(H2,19,20,24)/p+1