2-(2-azanylidene-6-methoxy-1,3-benzothiazol-3-yl)-1-(azepan-1-yl)ethanone

Systemtic Name: 2-(2-azanylidene-6-methoxy-1,3-benzothiazol-3-yl)-1-(azepan-1-yl)ethanone Openeye Name: 1-(azepan-1-yl)-2-(2-imino-6-methoxy-1,3-benzothiazol-3-yl)ethanone CAS Name: 1-(1-azepanyl)-2-(2-imino-6-methoxy-1,3-benzothiazol-3-yl)ethanone IUPAC Name: 1-(azepan-1-yl)-2-(2-imino-6-methoxy-1,3-benzothiazol-3-yl)ethanone Traditional Name: 1-(azepan-1-yl)-2-(2-imino-6-methoxy-1,3-benzothiazol-3-yl)ethanone Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=N)S2)CC(=O)N3CCCCCC3

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=N)S2)CC(=O)N3CCCCCC3

InChI

InChI=1S/C16H21N3O2S/c1-21-12-6-7-13-14(10-12)22-16(17)19(13)11-15(20)18-8-4-2-3-5-9-18/h6-7,10,17H,2-5,8-9,11H2,1H3