5-butyl-4-(3,4-dichlorophenyl)-6-methyl-7-piperazin-1-yl-1,3-benzothiazol-2-amine

Systemtic Name: 5-butyl-4-(3,4-dichlorophenyl)-6-methyl-7-piperazin-1-yl-1,3-benzothiazol-2-amine Openeye Name: 5-butyl-4-(3,4-dichlorophenyl)-6-methyl-7-piperazin-1-yl-1,3-benzothiazol-2-amine CAS Name: 5-butyl-4-(3,4-dichlorophenyl)-6-methyl-7-(1-piperazinyl)-1,3-benzothiazol-2-amine IUPAC Name: 5-butyl-4-(3,4-dichlorophenyl)-6-methyl-7-piperazin-1-yl-1,3-benzothiazol-2-amine Traditional Name: [5-butyl-4-(3,4-dichlorophenyl)-6-methyl-7-piperazino-1,3-benzothiazol-2-yl]amine Formula: C22H26Cl2N4S MolecularWeight: 449.43964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(C(=C1C)N3CCNCC3)SC(=N2)N)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CCCCC1=C(C2=C(C(=C1C)N3CCNCC3)SC(=N2)N)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H26Cl2N4S/c1-3-4-5-15-13(2)20(28-10-8-26-9-11-28)21-19(27-22(25)29-21)18(15)14-6-7-16(23)17(24)12-14/h6-7,12,26H,3-5,8-11H2,1-2H3,(H2,25,27)