6-[4-(2-ethoxy-2-phenyl-ethyl)piperazin-1-yl]sulfonyl-4-pyrrolidin-1-yl-quinazoline

Systemtic Name: 6-[4-(2-ethoxy-2-phenyl-ethyl)piperazin-1-yl]sulfonyl-4-pyrrolidin-1-yl-quinazoline Openeye Name: 6-[4-(2-ethoxy-2-phenyl-ethyl)piperazin-1-yl]sulfonyl-4-pyrrolidin-1-yl-quinazoline CAS Name: 6-[[4-(2-ethoxy-2-phenylethyl)-1-piperazinyl]sulfonyl]-4-(1-pyrrolidinyl)quinazoline IUPAC Name: 6-[4-(2-ethoxy-2-phenylethyl)piperazin-1-yl]sulfonyl-4-pyrrolidin-1-ylquinazoline Traditional Name: 6-[4-(2-ethoxy-2-phenyl-ethyl)piperazino]sulfonyl-4-pyrrolidino-quinazoline Formula: C26H33N5O3S MolecularWeight: 495.63692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=CN=C3N4CCCC4)C5=CC=CC=C5

Isomeric SMILES

CCOC(CN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=CN=C3N4CCCC4)C5=CC=CC=C5

InChI

InChI=1S/C26H33N5O3S/c1-2-34-25(21-8-4-3-5-9-21)19-29-14-16-31(17-15-29)35(32,33)22-10-11-24-23(18-22)26(28-20-27-24)30-12-6-7-13-30/h3-5,8-11,18,20,25H,2,6-7,12-17,19H2,1H3