N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide

Systemtic Name: N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide Openeye Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide CAS Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-[(4-methoxyphenyl)thio]propanamide IUPAC Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfanylpropanamide Traditional Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-[(4-methoxyphenyl)thio]propionamide Formula: C22H26ClN3O3S2 MolecularWeight: 480.04314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26ClN3O3S2/c1-25(2)12-13-26(19(27)11-14-30-16-7-5-15(28-3)6-8-16)22-24-20-18(29-4)10-9-17(23)21(20)31-22/h5-10H,11-14H2,1-4H3