N-(1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-[(4-methoxyphenyl)thio]propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfanylpropanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-[(4-methoxyphenyl)thio]propionamide Formula: C21H25N3O2S2 MolecularWeight: 415.5721

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=CC=CC=C2S1)C(=O)CCSC3=CC=C(C=C3)OC

Isomeric SMILES

CN(C)CCN(C1=NC2=CC=CC=C2S1)C(=O)CCSC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H25N3O2S2/c1-23(2)13-14-24(21-22-18-6-4-5-7-19(18)28-21)20(25)12-15-27-17-10-8-16(26-3)9-11-17/h4-11H,12-15H2,1-3H3