4-(4-chloranylbutyl)-7-ethanoyl-2,3-dihydrothieno[3,2-f][1,4]thiazepin-5-one

Systemtic Name: 4-(4-chloranylbutyl)-7-ethanoyl-2,3-dihydrothieno[3,2-f][1,4]thiazepin-5-one Openeye Name: 7-acetyl-4-(4-chlorobutyl)-2,3-dihydrothieno[3,2-f][1,4]thiazepin-5-one CAS Name: 7-acetyl-4-(4-chlorobutyl)-2,3-dihydrothieno[3,2-f][1,4]thiazepin-5-one IUPAC Name: 7-acetyl-4-(4-chlorobutyl)-2,3-dihydrothieno[3,2-f][1,4]thiazepin-5-one Traditional Name: 7-acetyl-4-(4-chlorobutyl)-2,3-dihydrothieno[3,2-f][1,4]thiazepin-5-one Formula: C13H16ClNO2S2 MolecularWeight: 317.85464

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(S1)SCCN(C2=O)CCCCCl

Isomeric SMILES

CC(=O)C1=CC2=C(S1)SCCN(C2=O)CCCCCl

InChI

InChI=1S/C13H16ClNO2S2/c1-9(16)11-8-10-12(17)15(5-3-2-4-14)6-7-18-13(10)19-11/h8H,2-7H2,1H3