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

Systemtic Name: 6-chloranyl-2-[(3R)-3-(4-ethylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-4-phenyl-quinazoline Openeye Name: 6-chloro-2-[(3R)-3-(4-ethylphenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-4-phenyl-quinazoline CAS Name: 6-chloro-2-[(3R)-3-(4-ethylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-4-phenylquinazoline IUPAC Name: 6-chloro-2-[(3R)-3-(4-ethylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-4-phenylquinazoline Traditional Name: 6-chloro-2-[(5R)-5-(4-ethylphenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]-4-phenyl-quinazoline Formula: C29H23ClN4S MolecularWeight: 495.03772

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2CC(=NN2C3=NC4=C(C=C(C=C4)Cl)C(=N3)C5=CC=CC=C5)C6=CC=CS6

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H]2CC(=NN2C3=NC4=C(C=C(C=C4)Cl)C(=N3)C5=CC=CC=C5)C6=CC=CS6

InChI

InChI=1S/C29H23ClN4S/c1-2-19-10-12-20(13-11-19)26-18-25(27-9-6-16-35-27)33-34(26)29-31-24-15-14-22(30)17-23(24)28(32-29)21-7-4-3-5-8-21/h3-17,26H,2,18H2,1H3/t26-/m1/s1