N-(1H-indol-5-yl)-6-methoxy-7-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propoxy]quinazolin-4-amine

Systemtic Name: N-(1H-indol-5-yl)-6-methoxy-7-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propoxy]quinazolin-4-amine Openeye Name: N-(1H-indol-5-yl)-6-methoxy-7-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propoxy]quinazolin-4-amine CAS Name: N-(1H-indol-5-yl)-6-methoxy-7-[3-[(4-methyl-1,2,4-triazol-3-yl)thio]propoxy]-4-quinazolinamine IUPAC Name: N-(1H-indol-5-yl)-6-methoxy-7-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propoxy]quinazolin-4-amine Traditional Name: 1H-indol-5-yl-[6-methoxy-7-[3-[(4-methyl-1,2,4-triazol-3-yl)thio]propoxy]quinazolin-4-yl]amine Formula: C23H23N7O2S MolecularWeight: 461.53942

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCCCOC2=C(C=C3C(=C2)N=CN=C3NC4=CC5=C(C=C4)NC=C5)OC

Isomeric SMILES

CN1C=NN=C1SCCCOC2=C(C=C3C(=C2)N=CN=C3NC4=CC5=C(C=C4)NC=C5)OC

InChI

InChI=1S/C23H23N7O2S/c1-30-14-27-29-23(30)33-9-3-8-32-21-12-19-17(11-20(21)31-2)22(26-13-25-19)28-16-4-5-18-15(10-16)6-7-24-18/h4-7,10-14,24H,3,8-9H2,1-2H3,(H,25,26,28)