1-(4-chloranyl-2-tetradecoxy-phenyl)-3-[3-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]urea

Systemtic Name: 1-(4-chloranyl-2-tetradecoxy-phenyl)-3-[3-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]urea Openeye Name: 1-(4-chloro-2-tetradecoxy-phenyl)-3-[3-[(4-methylthiazol-3-ium-3-yl)methyl]phenyl]urea CAS Name: 1-(4-chloro-2-tetradecoxyphenyl)-3-[3-[(4-methyl-3-thiazol-3-iumyl)methyl]phenyl]urea IUPAC Name: 1-(4-chloro-2-tetradecoxyphenyl)-3-[3-[(4-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenyl]urea Traditional Name: 1-(4-chloro-2-myristyloxy-phenyl)-3-[3-[(4-methylthiazol-3-ium-3-yl)methyl]phenyl]urea Formula: C32H45ClN3O2S+ MolecularWeight: 571.2366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=CC(=C1)Cl)NC(=O)NC2=CC=CC(=C2)C[N+]3=CSC=C3C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC(=C1)Cl)NC(=O)NC2=CC=CC(=C2)C[N+]3=CSC=C3C

InChI

InChI=1S/C32H44ClN3O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-20-38-31-22-28(33)18-19-30(31)35-32(37)34-29-17-15-16-27(21-29)23-36-25-39-24-26(36)2/h15-19,21-22,24-25H,3-14,20,23H2,1-2H3,(H-,34,35,37)/p+1