N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: 4-(4-benzylpiperazin-1-yl)sulfonyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: 4-(4-benzylpiperazin-1-yl)sulfonyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide Traditional Name: 4-(4-benzylpiperazino)sulfonyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide Formula: C26H27N3O5S MolecularWeight: 493.57468

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(=O)NC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(=O)NC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C26H27N3O5S/c30-26(27-22-8-11-24-25(18-22)34-17-16-33-24)21-6-9-23(10-7-21)35(31,32)29-14-12-28(13-15-29)19-20-4-2-1-3-5-20/h1-11,18H,12-17,19H2,(H,27,30)