N-[4-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-(4-benzylpiperazine-1-carbonyl)thiazol-2-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-2-thiazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-(4-benzylpiperazine-1-carbonyl)-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(4-benzylpiperazine-1-carbonyl)thiazol-2-yl]-piperonylamide Formula: C23H22N4O4S MolecularWeight: 450.51018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CSC(=N3)NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CSC(=N3)NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H22N4O4S/c28-21(17-6-7-19-20(12-17)31-15-30-19)25-23-24-18(14-32-23)22(29)27-10-8-26(9-11-27)13-16-4-2-1-3-5-16/h1-7,12,14H,8-11,13,15H2,(H,24,25,28)