4-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]-2-phenyl-quinazoline

Systemtic Name: 4-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]-2-phenyl-quinazoline Openeye Name: 4-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]-2-phenyl-quinazoline CAS Name: 4-[4-(3,4-diethoxyphenyl)sulfonyl-1-piperazinyl]-2-phenylquinazoline IUPAC Name: 4-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]-2-phenylquinazoline Traditional Name: 4-[4-(3,4-diethoxyphenyl)sulfonylpiperazino]-2-phenyl-quinazoline Formula: C28H30N4O4S MolecularWeight: 518.6272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CC=CC=C5)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CC=CC=C5)OCC

InChI

InChI=1S/C28H30N4O4S/c1-3-35-25-15-14-22(20-26(25)36-4-2)37(33,34)32-18-16-31(17-19-32)28-23-12-8-9-13-24(23)29-27(30-28)21-10-6-5-7-11-21/h5-15,20H,3-4,16-19H2,1-2H3