6-[4-(2-methoxy-2-phenyl-ethyl)piperazin-1-yl]sulfonyl-4-piperidin-1-yl-quinazoline

Systemtic Name: 6-[4-(2-methoxy-2-phenyl-ethyl)piperazin-1-yl]sulfonyl-4-piperidin-1-yl-quinazoline Openeye Name: 6-[4-(2-methoxy-2-phenyl-ethyl)piperazin-1-yl]sulfonyl-4-(1-piperidyl)quinazoline CAS Name: 6-[[4-(2-methoxy-2-phenylethyl)-1-piperazinyl]sulfonyl]-4-(1-piperidinyl)quinazoline IUPAC Name: 6-[4-(2-methoxy-2-phenylethyl)piperazin-1-yl]sulfonyl-4-piperidin-1-ylquinazoline Traditional Name: 6-[4-(2-methoxy-2-phenyl-ethyl)piperazino]sulfonyl-4-piperidino-quinazoline Formula: C26H33N5O3S MolecularWeight: 495.63692

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Descriptors Computed from Structure

Canonical SMILES:

COC(CN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=CN=C3N4CCCCC4)C5=CC=CC=C5

Isomeric SMILES

COC(CN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=CN=C3N4CCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C26H33N5O3S/c1-34-25(21-8-4-2-5-9-21)19-29-14-16-31(17-15-29)35(32,33)22-10-11-24-23(18-22)26(28-20-27-24)30-12-6-3-7-13-30/h2,4-5,8-11,18,20,25H,3,6-7,12-17,19H2,1H3