6-[4-[2-(azepan-1-yl)ethyl-methyl-amino]butyl]-3-methyl-1,3-benzothiazol-2-one

Systemtic Name: 6-[4-[2-(azepan-1-yl)ethyl-methyl-amino]butyl]-3-methyl-1,3-benzothiazol-2-one Openeye Name: 6-[4-[2-(azepan-1-yl)ethyl-methyl-amino]butyl]-3-methyl-1,3-benzothiazol-2-one CAS Name: 6-[4-[2-(1-azepanyl)ethyl-methylamino]butyl]-3-methyl-1,3-benzothiazol-2-one IUPAC Name: 6-[4-[2-(azepan-1-yl)ethyl-methylamino]butyl]-3-methyl-1,3-benzothiazol-2-one Traditional Name: 6-[4-[2-(azepan-1-yl)ethyl-methyl-amino]butyl]-3-methyl-1,3-benzothiazol-2-one Formula: C21H33N3OS MolecularWeight: 375.57122

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)CCCCN(C)CCN3CCCCCC3)SC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)CCCCN(C)CCN3CCCCCC3)SC1=O

InChI

InChI=1S/C21H33N3OS/c1-22(15-16-24-13-6-3-4-7-14-24)12-8-5-9-18-10-11-19-20(17-18)26-21(25)23(19)2/h10-11,17H,3-9,12-16H2,1-2H3