N-(2-dimethylaminoethyl)-4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-(2-dimethylaminoethyl)-4-[(3,5-dimethyl-1-piperidyl)sulfonyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-dimethylaminoethyl)-4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide IUPAC Name: N-(2-dimethylaminoethyl)-4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(2-dimethylaminoethyl)-4-(3,5-dimethylpiperidino)sulfonyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide Formula: C27H36N4O4S2 MolecularWeight: 544.72914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N(CCN(C)C)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CC(CC(C4)C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N(CCN(C)C)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CC(CC(C4)C)C

InChI

InChI=1S/C27H36N4O4S2/c1-6-35-22-9-12-24-25(16-22)36-27(28-24)31(14-13-29(4)5)26(32)21-7-10-23(11-8-21)37(33,34)30-17-19(2)15-20(3)18-30/h7-12,16,19-20H,6,13-15,17-18H2,1-5H3