4-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]quinazoline

Systemtic Name: 4-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]quinazoline Openeye Name: 4-(4-indan-5-ylsulfonylpiperazin-1-yl)quinazoline CAS Name: 4-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]quinazoline IUPAC Name: 4-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]quinazoline Traditional Name: 4-(4-indan-5-ylsulfonylpiperazino)quinazoline Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=NC=NC5=CC=CC=C54

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=NC=NC5=CC=CC=C54

InChI

InChI=1S/C21H22N4O2S/c26-28(27,18-9-8-16-4-3-5-17(16)14-18)25-12-10-24(11-13-25)21-19-6-1-2-7-20(19)22-15-23-21/h1-2,6-9,14-15H,3-5,10-13H2