6-chloranyl-2-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-4-phenyl-quinazoline

Systemtic Name: 6-chloranyl-2-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-4-phenyl-quinazoline Openeye Name: 6-chloro-2-[3-(3,4-dimethoxyphenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-4-phenyl-quinazoline CAS Name: 6-chloro-2-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-4-phenylquinazoline IUPAC Name: 6-chloro-2-[3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-4-phenylquinazoline Traditional Name: 6-chloro-2-[5-(3,4-dimethoxyphenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]-4-phenyl-quinazoline Formula: C29H23ClN4O2S MolecularWeight: 527.03652

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=NN2C3=NC4=C(C=C(C=C4)Cl)C(=N3)C5=CC=CC=C5)C6=CC=CS6)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(=NN2C3=NC4=C(C=C(C=C4)Cl)C(=N3)C5=CC=CC=C5)C6=CC=CS6)OC

InChI

InChI=1S/C29H23ClN4O2S/c1-35-25-13-10-19(15-26(25)36-2)24-17-23(27-9-6-14-37-27)33-34(24)29-31-22-12-11-20(30)16-21(22)28(32-29)18-7-4-3-5-8-18/h3-16,24H,17H2,1-2H3