[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(2,3-dimethyl-2,3-dihydro-1-benzofuran-7-yl)methanone

Systemtic Name: [2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(2,3-dimethyl-2,3-dihydro-1-benzofuran-7-yl)methanone Openeye Name: [2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(2,3-dimethyl-2,3-dihydrobenzofuran-7-yl)methanone CAS Name: [2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-(2,3-dimethyl-2,3-dihydrobenzofuran-7-yl)methanone IUPAC Name: [2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(2,3-dimethyl-2,3-dihydro-1-benzofuran-7-yl)methanone Traditional Name: [2-(1,3-benzothiazol-2-yl)pyrrolidino]-(2,3-dimethylcoumaran-7-yl)methanone Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=C(C=CC=C12)C(=O)N3CCCC3C4=NC5=CC=CC=C5S4)C

Isomeric SMILES

CC1C(OC2=C(C=CC=C12)C(=O)N3CCCC3C4=NC5=CC=CC=C5S4)C

InChI

InChI=1S/C22H22N2O2S/c1-13-14(2)26-20-15(13)7-5-8-16(20)22(25)24-12-6-10-18(24)21-23-17-9-3-4-11-19(17)27-21/h3-5,7-9,11,13-14,18H,6,10,12H2,1-2H3