ethyl N-[2-(azepan-1-yl)-1,3-benzothiazol-6-yl]carbamate

Systemtic Name: ethyl N-[2-(azepan-1-yl)-1,3-benzothiazol-6-yl]carbamate Openeye Name: ethyl N-[2-(azepan-1-yl)-1,3-benzothiazol-6-yl]carbamate CAS Name: N-[2-(1-azepanyl)-1,3-benzothiazol-6-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-(azepan-1-yl)-1,3-benzothiazol-6-yl]carbamate Traditional Name: N-[2-(azepan-1-yl)-1,3-benzothiazol-6-yl]carbamic acid ethyl ester Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)N=C(S2)N3CCCCCC3

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)N=C(S2)N3CCCCCC3

InChI

InChI=1S/C16H21N3O2S/c1-2-21-16(20)17-12-7-8-13-14(11-12)22-15(18-13)19-9-5-3-4-6-10-19/h7-8,11H,2-6,9-10H2,1H3,(H,17,20)