N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-propan-2-yloxy-benzamide

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-propan-2-yloxy-benzamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-isopropoxy-benzamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-propan-2-yloxybenzamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-propan-2-yloxybenzamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-isopropoxy-benzamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)N(CCN(C)C)C2=NC3=C(S2)C=CC=C3Cl

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)N(CCN(C)C)C2=NC3=C(S2)C=CC=C3Cl

InChI

InChI=1S/C21H24ClN3O2S/c1-14(2)27-16-10-8-15(9-11-16)20(26)25(13-12-24(3)4)21-23-19-17(22)6-5-7-18(19)28-21/h5-11,14H,12-13H2,1-4H3