N-[2-(phenylsulfonyl)-9-prop-2-enyl-pyrimido[4,5-b]indol-4-yl]benzamide

Systemtic Name: N-[2-(phenylsulfonyl)-9-prop-2-enyl-pyrimido[4,5-b]indol-4-yl]benzamide Openeye Name: N-[9-allyl-2-(benzenesulfonyl)pyrimido[4,5-b]indol-4-yl]benzamide CAS Name: N-[2-(benzenesulfonyl)-9-prop-2-enyl-4-pyrimido[4,5-b]indolyl]benzamide IUPAC Name: N-[2-(benzenesulfonyl)-9-prop-2-enylpyrimido[4,5-b]indol-4-yl]benzamide Traditional Name: N-(9-allyl-2-besyl-pyrimid[4,5-b]indol-4-yl)benzamide Formula: C26H20N4O3S MolecularWeight: 468.527

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC=CC=C2C3=C1N=C(N=C3NC(=O)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C=CCN1C2=CC=CC=C2C3=C1N=C(N=C3NC(=O)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H20N4O3S/c1-2-17-30-21-16-10-9-15-20(21)22-23(27-25(31)18-11-5-3-6-12-18)28-26(29-24(22)30)34(32,33)19-13-7-4-8-14-19/h2-16H,1,17H2,(H,27,28,29,31)