N-(3-bromophenyl)-6-[(E)-5-morpholin-4-ylpent-1-enyl]sulfonyl-pyrido[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(3-bromophenyl)-6-[(E)-5-morpholin-4-ylpent-1-enyl]sulfonyl-pyrido[3,4-d]pyrimidin-4-amine Openeye Name: N-(3-bromophenyl)-6-[(E)-5-morpholinopent-1-enyl]sulfonyl-pyrido[3,4-d]pyrimidin-4-amine CAS Name: N-(3-bromophenyl)-6-[(E)-5-(4-morpholinyl)pent-1-enyl]sulfonyl-4-pyrido[3,4-d]pyrimidinamine IUPAC Name: N-(3-bromophenyl)-6-[(E)-5-morpholin-4-ylpent-1-enyl]sulfonylpyrido[3,4-d]pyrimidin-4-amine Traditional Name: (3-bromophenyl)-[6-[(E)-5-morpholinopent-1-enyl]sulfonylpyrido[3,4-d]pyrimidin-4-yl]amine Formula: C22H24BrN5O3S MolecularWeight: 518.42666

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCC=CS(=O)(=O)C2=NC=C3C(=C2)C(=NC=N3)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1COCCN1CCC/C=C/S(=O)(=O)C2=NC=C3C(=C2)C(=NC=N3)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C22H24BrN5O3S/c23-17-5-4-6-18(13-17)27-22-19-14-21(24-15-20(19)25-16-26-22)32(29,30)12-3-1-2-7-28-8-10-31-11-9-28/h3-6,12-16H,1-2,7-11H2,(H,25,26,27)/b12-3+