5-(1,3-benzothiazol-2-yl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]thiophene-2-carboxamide

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]thiophene-2-carboxamide Openeye Name: 5-(1,3-benzothiazol-2-yl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]thiophene-2-carboxamide CAS Name: 5-(1,3-benzothiazol-2-yl)-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-2-thiophenecarboxamide IUPAC Name: 5-(1,3-benzothiazol-2-yl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]thiophene-2-carboxamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-[3-[4-(2-pyrimidyl)piperazino]propyl]thiophene-2-carboxamide Formula: C23H24N6OS2 MolecularWeight: 464.60626

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)C2=CC=C(S2)C3=NC4=CC=CC=C4S3)C5=NC=CC=N5

Isomeric SMILES

C1CN(CCN1CCCNC(=O)C2=CC=C(S2)C3=NC4=CC=CC=C4S3)C5=NC=CC=N5

InChI

InChI=1S/C23H24N6OS2/c30-21(19-7-8-20(31-19)22-27-17-5-1-2-6-18(17)32-22)24-11-4-12-28-13-15-29(16-14-28)23-25-9-3-10-26-23/h1-3,5-10H,4,11-16H2,(H,24,30)