N-(1,3-benzodioxol-5-yl)-4-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperazine-1-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperazine-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-[(4-phenylthiazol-2-yl)methyl]piperazine-1-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-[(4-phenyl-2-thiazolyl)methyl]-1-piperazinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-[(4-phenyl-1,3-thiazol-2-yl)methyl]piperazine-1-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-[(4-phenylthiazol-2-yl)methyl]piperazine-1-carboxamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=CS2)C3=CC=CC=C3)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1CC2=NC(=CS2)C3=CC=CC=C3)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H22N4O3S/c27-22(23-17-6-7-19-20(12-17)29-15-28-19)26-10-8-25(9-11-26)13-21-24-18(14-30-21)16-4-2-1-3-5-16/h1-7,12,14H,8-11,13,15H2,(H,23,27)