N-[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl]-N-ethyl-9-ethylsulfonyl-6-(oxan-4-yl)-5,6,7,8-tetrahydrocarbazole-3-carboxamide

Systemtic Name: N-[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl]-N-ethyl-9-ethylsulfonyl-6-(oxan-4-yl)-5,6,7,8-tetrahydrocarbazole-3-carboxamide Openeye Name: N-[2-(2-cyanoethylamino)-2-oxo-ethyl]-N-ethyl-9-ethylsulfonyl-6-tetrahydropyran-4-yl-5,6,7,8-tetrahydrocarbazole-3-carboxamide CAS Name: N-[2-(2-cyanoethylamino)-2-oxoethyl]-N-ethyl-9-ethylsulfonyl-6-(4-oxanyl)-5,6,7,8-tetrahydrocarbazole-3-carboxamide IUPAC Name: N-[2-(2-cyanoethylamino)-2-oxoethyl]-N-ethyl-9-ethylsulfonyl-6-(oxan-4-yl)-5,6,7,8-tetrahydrocarbazole-3-carboxamide Traditional Name: N-[2-(2-cyanoethylamino)-2-keto-ethyl]-9-esyl-N-ethyl-6-tetrahydropyran-4-yl-5,6,7,8-tetrahydrocarbazole-3-carboxamide Formula: C27H36N4O5S MolecularWeight: 528.66354

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCCC#N)C(=O)C1=CC2=C(C=C1)N(C3=C2CC(CC3)C4CCOCC4)S(=O)(=O)CC

Isomeric SMILES

CCN(CC(=O)NCCC#N)C(=O)C1=CC2=C(C=C1)N(C3=C2CC(CC3)C4CCOCC4)S(=O)(=O)CC

InChI

InChI=1S/C27H36N4O5S/c1-3-30(18-26(32)29-13-5-12-28)27(33)21-7-9-25-23(17-21)22-16-20(19-10-14-36-15-11-19)6-8-24(22)31(25)37(34,35)4-2/h7,9,17,19-20H,3-6,8,10-11,13-16,18H2,1-2H3,(H,29,32)