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

Systemtic Name: 3-[(2-methyl-1,3-benzothiazol-6-yl)amino]azepan-2-one Openeye Name: 3-[(2-methyl-1,3-benzothiazol-6-yl)amino]azepan-2-one CAS Name: 3-[(2-methyl-1,3-benzothiazol-6-yl)amino]-2-azepanone IUPAC Name: 3-[(2-methyl-1,3-benzothiazol-6-yl)amino]azepan-2-one Traditional Name: 3-[(2-methyl-1,3-benzothiazol-6-yl)amino]azepan-2-one Formula: C14H17N3OS MolecularWeight: 275.36928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC3CCCCNC3=O

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC3CCCCNC3=O

InChI

InChI=1S/C14H17N3OS/c1-9-16-11-6-5-10(8-13(11)19-9)17-12-4-2-3-7-15-14(12)18/h5-6,8,12,17H,2-4,7H2,1H3,(H,15,18)