N-[2-(cyclohexen-1-yl)-1-pyrrolidin-2-yl-ethyl]-5-(cyclopropylmethylsulfonyl)-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide; methane

Systemtic Name: N-[2-(cyclohexen-1-yl)-1-pyrrolidin-2-yl-ethyl]-5-(cyclopropylmethylsulfonyl)-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide; methane Openeye Name: N-[2-(cyclohexen-1-yl)-1-pyrrolidin-2-yl-ethyl]-5-(cyclopropylmethylsulfonyl)-2-methyl-2,3-dihydrobenzofuran-7-carboxamide; methane CAS Name: N-[2-(1-cyclohexenyl)-1-(2-pyrrolidinyl)ethyl]-5-(cyclopropylmethylsulfonyl)-2-methyl-2,3-dihydrobenzofuran-7-carboxamide; methane IUPAC Name: N-[2-(cyclohexen-1-yl)-1-pyrrolidin-2-ylethyl]-5-(cyclopropylmethylsulfonyl)-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide; methane Traditional Name: N-[2-(cyclohexen-1-yl)-1-pyrrolidin-2-yl-ethyl]-5-(cyclopropylmethylsulfonyl)-2-methyl-coumaran-7-carboxamide; methane Formula: C27H40N2O4S MolecularWeight: 488.6825

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Descriptors Computed from Structure

Canonical SMILES:

C.CC1CC2=C(O1)C(=CC(=C2)S(=O)(=O)CC3CC3)C(=O)NC(CC4=CCCCC4)C5CCCN5

Isomeric SMILES

C.CC1CC2=C(O1)C(=CC(=C2)S(=O)(=O)CC3CC3)C(=O)NC(CC4=CCCCC4)C5CCCN5

InChI

InChI=1S/C26H36N2O4S.CH4/c1-17-12-20-14-21(33(30,31)16-19-9-10-19)15-22(25(20)32-17)26(29)28-24(23-8-5-11-27-23)13-18-6-3-2-4-7-18;/h6,14-15,17,19,23-24,27H,2-5,7-13,16H2,1H3,(H,28,29);1H4