N-(2-dimethylaminoethyl)-4-ethylsulfanyl-N-(4-methoxy-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-ethylsulfanyl-N-(4-methoxy-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-(2-dimethylaminoethyl)-4-ethylsulfanyl-N-(4-methoxy-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-dimethylaminoethyl)-4-(ethylthio)-N-(4-methoxy-1,3-benzothiazol-2-yl)benzamide IUPAC Name: N-(2-dimethylaminoethyl)-4-ethylsulfanyl-N-(4-methoxy-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(2-dimethylaminoethyl)-4-(ethylthio)-N-(4-methoxy-1,3-benzothiazol-2-yl)benzamide Formula: C21H25N3O2S2 MolecularWeight: 415.5721

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)C(=O)N(CCN(C)C)C2=NC3=C(C=CC=C3S2)OC

Isomeric SMILES

CCSC1=CC=C(C=C1)C(=O)N(CCN(C)C)C2=NC3=C(C=CC=C3S2)OC

InChI

InChI=1S/C21H25N3O2S2/c1-5-27-16-11-9-15(10-12-16)20(25)24(14-13-23(2)3)21-22-19-17(26-4)7-6-8-18(19)28-21/h6-12H,5,13-14H2,1-4H3