N-(2-dimethylaminoethyl)-4-(2-ethylpiperidin-1-yl)sulfonyl-N-(6-fluoranyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-(2-ethylpiperidin-1-yl)sulfonyl-N-(6-fluoranyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-(2-dimethylaminoethyl)-4-[(2-ethyl-1-piperidyl)sulfonyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-dimethylaminoethyl)-4-[(2-ethyl-1-piperidinyl)sulfonyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide IUPAC Name: N-(2-dimethylaminoethyl)-4-(2-ethylpiperidin-1-yl)sulfonyl-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(2-dimethylaminoethyl)-4-(2-ethylpiperidino)sulfonyl-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide Formula: C25H31FN4O3S2 MolecularWeight: 518.667043

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCN(C)C)C3=NC4=C(S3)C=C(C=C4)F

Isomeric SMILES

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCN(C)C)C3=NC4=C(S3)C=C(C=C4)F

InChI

InChI=1S/C25H31FN4O3S2/c1-4-20-7-5-6-14-30(20)35(32,33)21-11-8-18(9-12-21)24(31)29(16-15-28(2)3)25-27-22-13-10-19(26)17-23(22)34-25/h8-13,17,20H,4-7,14-16H2,1-3H3