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

Systemtic Name: 5-bromanyl-N-[2-(phenylsulfonyl)-9-prop-2-enyl-pyrimido[4,5-b]indol-4-yl]furan-2-carboxamide Openeye Name: N-[9-allyl-2-(benzenesulfonyl)pyrimido[4,5-b]indol-4-yl]-5-bromo-furan-2-carboxamide CAS Name: N-[2-(benzenesulfonyl)-9-prop-2-enyl-4-pyrimido[4,5-b]indolyl]-5-bromo-2-furancarboxamide IUPAC Name: N-[2-(benzenesulfonyl)-9-prop-2-enylpyrimido[4,5-b]indol-4-yl]-5-bromofuran-2-carboxamide Traditional Name: N-(9-allyl-2-besyl-pyrimid[4,5-b]indol-4-yl)-5-bromo-2-furamide Formula: C24H17BrN4O4S MolecularWeight: 537.38518

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC=CC=C2C3=C1N=C(N=C3NC(=O)C4=CC=C(O4)Br)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C=CCN1C2=CC=CC=C2C3=C1N=C(N=C3NC(=O)C4=CC=C(O4)Br)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H17BrN4O4S/c1-2-14-29-17-11-7-6-10-16(17)20-21(26-23(30)18-12-13-19(25)33-18)27-24(28-22(20)29)34(31,32)15-8-4-3-5-9-15/h2-13H,1,14H2,(H,26,27,28,30)