3-(1,3-benzothiazol-2-yl)-1-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]propan-1-one

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-1-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]propan-1-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-1-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]propan-1-one CAS Name: 3-(1,3-benzothiazol-2-yl)-1-[2-(4-ethoxyphenyl)-1-pyrrolidinyl]-1-propanone IUPAC Name: 3-(1,3-benzothiazol-2-yl)-1-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]propan-1-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-1-(2-p-phenetylpyrrolidino)propan-1-one Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2C(=O)CCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CCCN2C(=O)CCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H24N2O2S/c1-2-26-17-11-9-16(10-12-17)19-7-5-15-24(19)22(25)14-13-21-23-18-6-3-4-8-20(18)27-21/h3-4,6,8-12,19H,2,5,7,13-15H2,1H3