3-azanyl-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-azanyl-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]benzothiophene-2-carboxamide CAS Name: 3-amino-N-[4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]butyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazino]butyl]benzothiophene-2-carboxamide Formula: C24H27N5OS2 MolecularWeight: 465.63408

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCNC(=O)C2=C(C3=CC=CC=C3S2)N)C4=NSC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CCCCNC(=O)C2=C(C3=CC=CC=C3S2)N)C4=NSC5=CC=CC=C54

InChI

InChI=1S/C24H27N5OS2/c25-21-17-7-1-3-9-19(17)31-22(21)24(30)26-11-5-6-12-28-13-15-29(16-14-28)23-18-8-2-4-10-20(18)32-27-23/h1-4,7-10H,5-6,11-16,25H2,(H,26,30)