6-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]sulfonyl-4-piperidin-1-yl-quinazoline dihydrochloride

Systemtic Name: 6-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]sulfonyl-4-piperidin-1-yl-quinazoline dihydrochloride Openeye Name: 6-[4-[(E)-cinnamyl]piperazin-1-yl]sulfonyl-4-(1-piperidyl)quinazoline dihydrochloride CAS Name: 6-[[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]sulfonyl]-4-(1-piperidinyl)quinazoline dihydrochloride IUPAC Name: 6-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]sulfonyl-4-piperidin-1-ylquinazoline dihydrochloride Traditional Name: 6-[4-[(E)-cinnamyl]piperazino]sulfonyl-4-piperidino-quinazoline dihydrochloride Formula: C26H33Cl2N5O2S MolecularWeight: 550.54352

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=NC3=C2C=C(C=C3)S(=O)(=O)N4CCN(CC4)CC=CC5=CC=CC=C5.Cl.Cl

Isomeric SMILES

C1CCN(CC1)C2=NC=NC3=C2C=C(C=C3)S(=O)(=O)N4CCN(CC4)C/C=C/C5=CC=CC=C5.Cl.Cl

InChI

InChI=1S/C26H31N5O2S.2ClH/c32-34(33,31-18-16-29(17-19-31)13-7-10-22-8-3-1-4-9-22)23-11-12-25-24(20-23)26(28-21-27-25)30-14-5-2-6-15-30;;/h1,3-4,7-12,20-21H,2,5-6,13-19H2;2*1H/b10-7+;;