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

Systemtic Name: 2-(1,3-benzothiazol-2-ylamino)-1-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]propan-1-one Openeye Name: 2-(1,3-benzothiazol-2-ylamino)-1-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]propan-1-one CAS Name: 2-(1,3-benzothiazol-2-ylamino)-1-[2-(4-ethoxyphenyl)-1-pyrrolidinyl]-1-propanone IUPAC Name: 2-(1,3-benzothiazol-2-ylamino)-1-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]propan-1-one Traditional Name: 2-(1,3-benzothiazol-2-ylamino)-1-(2-p-phenetylpyrrolidino)propan-1-one Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2C(=O)C(C)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CCCN2C(=O)C(C)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H25N3O2S/c1-3-27-17-12-10-16(11-13-17)19-8-6-14-25(19)21(26)15(2)23-22-24-18-7-4-5-9-20(18)28-22/h4-5,7,9-13,15,19H,3,6,8,14H2,1-2H3,(H,23,24)