2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethyl]-4-piperidin-1-yl-quinazoline

Systemtic Name: 2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethyl]-4-piperidin-1-yl-quinazoline Openeye Name: 2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethyl]-4-(1-piperidyl)quinazoline CAS Name: 2-[1-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]ethyl]-4-(1-piperidinyl)quinazoline IUPAC Name: 2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethyl]-4-piperidin-1-ylquinazoline Traditional Name: 2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazino]ethyl]-4-piperidino-quinazoline Formula: C29H39N5O2S MolecularWeight: 521.71726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2C(=N1)N3CCCCC3)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CC(C1=NC2=CC=CC=C2C(=N1)N3CCCCC3)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C29H39N5O2S/c1-22(27-30-26-11-7-6-10-25(26)28(31-27)33-16-8-5-9-17-33)32-18-20-34(21-19-32)37(35,36)24-14-12-23(13-15-24)29(2,3)4/h6-7,10-15,22H,5,8-9,16-21H2,1-4H3