N-(1,3-benzodioxol-5-ylmethyl)-4-(pyridin-4-ylmethylamino)-1,2-thiazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(pyridin-4-ylmethylamino)-1,2-thiazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-pyridylmethylamino)isothiazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(pyridin-4-ylmethylamino)-3-isothiazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(pyridin-4-ylmethylamino)-1,2-thiazole-3-carboxamide Traditional Name: N-piperonyl-4-(4-pyridylmethylamino)isothiazole-3-carboxamide Formula: C18H16N4O3S MolecularWeight: 368.40964

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=NSC=C3NCC4=CC=NC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=NSC=C3NCC4=CC=NC=C4

InChI

InChI=1S/C18H16N4O3S/c23-18(21-9-13-1-2-15-16(7-13)25-11-24-15)17-14(10-26-22-17)20-8-12-3-5-19-6-4-12/h1-7,10,20H,8-9,11H2,(H,21,23)