[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(3,4-diethoxyphenyl)methanone

Systemtic Name: [2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(3,4-diethoxyphenyl)methanone Openeye Name: [2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(3,4-diethoxyphenyl)methanone CAS Name: [2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-(3,4-diethoxyphenyl)methanone IUPAC Name: [2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-(3,4-diethoxyphenyl)methanone Traditional Name: [2-(1,3-benzothiazol-2-yl)pyrrolidino]-(3,4-diethoxyphenyl)methanone Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCCC2C3=NC4=CC=CC=C4S3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCCC2C3=NC4=CC=CC=C4S3)OCC

InChI

InChI=1S/C22H24N2O3S/c1-3-26-18-12-11-15(14-19(18)27-4-2)22(25)24-13-7-9-17(24)21-23-16-8-5-6-10-20(16)28-21/h5-6,8,10-12,14,17H,3-4,7,9,13H2,1-2H3