2-[4-[6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]oxyphenyl]-1,3-benzothiazole

Systemtic Name: 2-[4-[6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]oxyphenyl]-1,3-benzothiazole Openeye Name: 2-[4-[6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]oxyphenyl]-1,3-benzothiazole CAS Name: 2-[4-[[6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]-4-quinazolinyl]oxy]phenyl]-1,3-benzothiazole IUPAC Name: 2-[4-[6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]oxyphenyl]-1,3-benzothiazole Traditional Name: 2-[4-[6-methoxy-7-(3-pyrrolidinopropoxy)quinazolin-4-yl]oxyphenyl]-1,3-benzothiazole Formula: C29H28N4O3S MolecularWeight: 512.62262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4)OCCCN6CCCC6

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4)OCCCN6CCCC6

InChI

InChI=1S/C29H28N4O3S/c1-34-25-17-22-24(18-26(25)35-16-6-15-33-13-4-5-14-33)30-19-31-28(22)36-21-11-9-20(10-12-21)29-32-23-7-2-3-8-27(23)37-29/h2-3,7-12,17-19H,4-6,13-16H2,1H3