N-(6-chloranyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-propan-2-yloxy-benzamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-propan-2-yloxy-benzamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-isopropoxy-benzamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-propan-2-yloxybenzamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-propan-2-yloxybenzamide Traditional Name: N-(6-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=C(C=C3)Cl

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)N(CCN(C)C)C2=NC3=C(S2)C=C(C=C3)Cl

InChI

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