N-(cyclohexen-1-yl)-N-ethyl-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(cyclohexen-1-yl)-N-ethyl-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(cyclohexen-1-yl)-N-ethyl-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide CAS Name: N-(1-cyclohexenyl)-N-ethyl-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide IUPAC Name: N-(cyclohexen-1-yl)-N-ethyl-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide Traditional Name: N-(cyclohexen-1-yl)-N-ethyl-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide Formula: C17H19N3O3S2 MolecularWeight: 377.48106

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CCCCC1)C(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(C1=CCCCC1)C(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O3S2/c1-2-19(12-6-4-3-5-7-12)16(21)11-24-17-18-14-9-8-13(20(22)23)10-15(14)25-17/h6,8-10H,2-5,7,11H2,1H3