2-[4-(2-azanylidene-6-chloranyl-1,3-benzothiazol-3-yl)butyl-methyl-amino]-1-(4-methylphenyl)ethanol

Systemtic Name: 2-[4-(2-azanylidene-6-chloranyl-1,3-benzothiazol-3-yl)butyl-methyl-amino]-1-(4-methylphenyl)ethanol Openeye Name: 2-[4-(6-chloro-2-imino-1,3-benzothiazol-3-yl)butyl-methyl-amino]-1-(p-tolyl)ethanol CAS Name: 2-[4-(6-chloro-2-imino-1,3-benzothiazol-3-yl)butyl-methylamino]-1-(4-methylphenyl)ethanol IUPAC Name: 2-[4-(6-chloro-2-imino-1,3-benzothiazol-3-yl)butyl-methylamino]-1-(4-methylphenyl)ethanol Traditional Name: 2-[4-(6-chloro-2-imino-1,3-benzothiazol-3-yl)butyl-methyl-amino]-1-(p-tolyl)ethanol Formula: C21H26ClN3OS MolecularWeight: 403.96864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CN(C)CCCCN2C3=C(C=C(C=C3)Cl)SC2=N)O

Isomeric SMILES

CC1=CC=C(C=C1)C(CN(C)CCCCN2C3=C(C=C(C=C3)Cl)SC2=N)O

InChI

InChI=1S/C21H26ClN3OS/c1-15-5-7-16(8-6-15)19(26)14-24(2)11-3-4-12-25-18-10-9-17(22)13-20(18)27-21(25)23/h5-10,13,19,23,26H,3-4,11-12,14H2,1-2H3