N-(1H-indol-5-yl)-6-methoxy-7-[[1-(2-methylsulfonylethyl)piperidin-4-yl]methoxy]quinazolin-4-amine

Systemtic Name: N-(1H-indol-5-yl)-6-methoxy-7-[[1-(2-methylsulfonylethyl)piperidin-4-yl]methoxy]quinazolin-4-amine Openeye Name: N-(1H-indol-5-yl)-6-methoxy-7-[[1-(2-methylsulfonylethyl)-4-piperidyl]methoxy]quinazolin-4-amine CAS Name: N-(1H-indol-5-yl)-6-methoxy-7-[[1-(2-methylsulfonylethyl)-4-piperidinyl]methoxy]-4-quinazolinamine IUPAC Name: N-(1H-indol-5-yl)-6-methoxy-7-[[1-(2-methylsulfonylethyl)piperidin-4-yl]methoxy]quinazolin-4-amine Traditional Name: 1H-indol-5-yl-[7-[[1-(2-mesylethyl)-4-piperidyl]methoxy]-6-methoxy-quinazolin-4-yl]amine Formula: C26H31N5O4S MolecularWeight: 509.62044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC4=C(C=C3)NC=C4)OCC5CCN(CC5)CCS(=O)(=O)C

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC4=C(C=C3)NC=C4)OCC5CCN(CC5)CCS(=O)(=O)C

InChI

InChI=1S/C26H31N5O4S/c1-34-24-14-21-23(28-17-29-26(21)30-20-3-4-22-19(13-20)5-8-27-22)15-25(24)35-16-18-6-9-31(10-7-18)11-12-36(2,32)33/h3-5,8,13-15,17-18,27H,6-7,9-12,16H2,1-2H3,(H,28,29,30)