5-piperazin-1-yl-4-propyl-6-[3-(trifluoromethyl)phenyl]-1,3-benzothiazol-2-amine

Systemtic Name: 5-piperazin-1-yl-4-propyl-6-[3-(trifluoromethyl)phenyl]-1,3-benzothiazol-2-amine Openeye Name: 5-piperazin-1-yl-4-propyl-6-[3-(trifluoromethyl)phenyl]-1,3-benzothiazol-2-amine CAS Name: 5-(1-piperazinyl)-4-propyl-6-[3-(trifluoromethyl)phenyl]-1,3-benzothiazol-2-amine IUPAC Name: 5-piperazin-1-yl-4-propyl-6-[3-(trifluoromethyl)phenyl]-1,3-benzothiazol-2-amine Traditional Name: [5-piperazino-4-propyl-6-[3-(trifluoromethyl)phenyl]-1,3-benzothiazol-2-yl]amine Formula: C21H23F3N4S MolecularWeight: 420.49433

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=CC2=C1N=C(S2)N)C3=CC(=CC=C3)C(F)(F)F)N4CCNCC4

Isomeric SMILES

CCCC1=C(C(=CC2=C1N=C(S2)N)C3=CC(=CC=C3)C(F)(F)F)N4CCNCC4

InChI

InChI=1S/C21H23F3N4S/c1-2-4-15-18-17(29-20(25)27-18)12-16(19(15)28-9-7-26-8-10-28)13-5-3-6-14(11-13)21(22,23)24/h3,5-6,11-12,26H,2,4,7-10H2,1H3,(H2,25,27)