6-[4-[(3-oxabicyclo[3.1.0]hexan-6-ylamino)methyl]phenyl]-N-[1-(phenylsulfonyl)indol-5-yl]quinazolin-4-amine

Systemtic Name: 6-[4-[(3-oxabicyclo[3.1.0]hexan-6-ylamino)methyl]phenyl]-N-[1-(phenylsulfonyl)indol-5-yl]quinazolin-4-amine Openeye Name: N-[1-(benzenesulfonyl)indol-5-yl]-6-[4-[(3-oxabicyclo[3.1.0]hexan-6-ylamino)methyl]phenyl]quinazolin-4-amine CAS Name: N-[1-(benzenesulfonyl)-5-indolyl]-6-[4-[(3-oxabicyclo[3.1.0]hexan-6-ylamino)methyl]phenyl]-4-quinazolinamine IUPAC Name: N-[1-(benzenesulfonyl)indol-5-yl]-6-[4-[(3-oxabicyclo[3.1.0]hexan-6-ylamino)methyl]phenyl]quinazolin-4-amine Traditional Name: (1-besylindol-5-yl)-[6-[4-[(3-oxabicyclo[3.1.0]hexan-6-ylamino)methyl]phenyl]quinazolin-4-yl]amine Formula: C34H29N5O3S MolecularWeight: 587.69076

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(C2NCC3=CC=C(C=C3)C4=CC5=C(C=C4)N=CN=C5NC6=CC7=C(C=C6)N(C=C7)S(=O)(=O)C8=CC=CC=C8)CO1

Isomeric SMILES

C1C2C(C2NCC3=CC=C(C=C3)C4=CC5=C(C=C4)N=CN=C5NC6=CC7=C(C=C6)N(C=C7)S(=O)(=O)C8=CC=CC=C8)CO1

InChI

InChI=1S/C34H29N5O3S/c40-43(41,27-4-2-1-3-5-27)39-15-14-25-16-26(11-13-32(25)39)38-34-28-17-24(10-12-31(28)36-21-37-34)23-8-6-22(7-9-23)18-35-33-29-19-42-20-30(29)33/h1-17,21,29-30,33,35H,18-20H2,(H,36,37,38)