N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]acetamide CAS Name: N-[(1,3-benzodioxol-5-ylamino)-oxomethyl]-2-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]acetamide Traditional Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(1,3-benzothiazol-2-ylmethyl)piperazino]acetamide Formula: C22H23N5O4S MolecularWeight: 453.51412

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3S2)CC(=O)NC(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3S2)CC(=O)NC(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H23N5O4S/c28-20(25-22(29)23-15-5-6-17-18(11-15)31-14-30-17)12-26-7-9-27(10-8-26)13-21-24-16-3-1-2-4-19(16)32-21/h1-6,11H,7-10,12-14H2,(H2,23,25,28,29)