N-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-4-pyridin-2-yl-piperazine-1-carboxamide

Systemtic Name: N-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-4-pyridin-2-yl-piperazine-1-carboxamide Openeye Name: N-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]thiazol-2-yl]-4-(2-pyridyl)piperazine-1-carboxamide CAS Name: N-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-2-thiazolyl]-4-(2-pyridinyl)-1-piperazinecarboxamide IUPAC Name: N-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-1,3-thiazol-2-yl]-4-pyridin-2-ylpiperazine-1-carboxamide Traditional Name: N-[4-[2-keto-2-(piperonylamino)ethyl]thiazol-2-yl]-4-(2-pyridyl)piperazine-1-carboxamide Formula: C23H24N6O4S MolecularWeight: 480.53946

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)NC3=NC(=CS3)CC(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)NC3=NC(=CS3)CC(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H24N6O4S/c30-21(25-13-16-4-5-18-19(11-16)33-15-32-18)12-17-14-34-22(26-17)27-23(31)29-9-7-28(8-10-29)20-3-1-2-6-24-20/h1-6,11,14H,7-10,12-13,15H2,(H,25,30)(H,26,27,31)