5-(1,3-benzothiazol-2-yl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]thiophene-2-carboxamide

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]thiophene-2-carboxamide Openeye Name: 5-(1,3-benzothiazol-2-yl)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]thiophene-2-carboxamide CAS Name: 5-(1,3-benzothiazol-2-yl)-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-2-thiophenecarboxamide IUPAC Name: 5-(1,3-benzothiazol-2-yl)-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]thiophene-2-carboxamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-[6-(3-ketopiperazino)-3-pyridyl]thiophene-2-carboxamide Formula: C21H17N5O2S2 MolecularWeight: 435.52198

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)C3=CC=C(S3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)C3=CC=C(S3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H17N5O2S2/c27-19-12-26(10-9-22-19)18-8-5-13(11-23-18)24-20(28)16-6-7-17(29-16)21-25-14-3-1-2-4-15(14)30-21/h1-8,11H,9-10,12H2,(H,22,27)(H,24,28)