N-(6-chloranyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-ethylsulfanyl-benzamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-ethylsulfanyl-benzamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-ethylsulfanyl-benzamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(ethylthio)benzamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-ethylsulfanylbenzamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-(ethylthio)benzamide Formula: C20H22ClN3OS2 MolecularWeight: 419.99118

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC(=C1)C(=O)N(CCN(C)C)C2=NC3=C(S2)C=C(C=C3)Cl

Isomeric SMILES

CCSC1=CC=CC(=C1)C(=O)N(CCN(C)C)C2=NC3=C(S2)C=C(C=C3)Cl

InChI

InChI=1S/C20H22ClN3OS2/c1-4-26-16-7-5-6-14(12-16)19(25)24(11-10-23(2)3)20-22-17-9-8-15(21)13-18(17)27-20/h5-9,12-13H,4,10-11H2,1-3H3