4-[(3-chloranyl-4-methyl-1-benzothiophen-2-yl)carbonyl]piperazin-2-one

Systemtic Name: 4-[(3-chloranyl-4-methyl-1-benzothiophen-2-yl)carbonyl]piperazin-2-one Openeye Name: 4-(3-chloro-4-methyl-benzothiophene-2-carbonyl)piperazin-2-one CAS Name: 4-[(3-chloro-4-methyl-1-benzothiophen-2-yl)-oxomethyl]-2-piperazinone IUPAC Name: 4-(3-chloro-4-methyl-1-benzothiophene-2-carbonyl)piperazin-2-one Traditional Name: 4-(3-chloro-4-methyl-benzothiophene-2-carbonyl)piperazin-2-one Formula: C14H13ClN2O2S MolecularWeight: 308.78322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=C2Cl)C(=O)N3CCNC(=O)C3

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=C2Cl)C(=O)N3CCNC(=O)C3

InChI

InChI=1S/C14H13ClN2O2S/c1-8-3-2-4-9-11(8)12(15)13(20-9)14(19)17-6-5-16-10(18)7-17/h2-4H,5-7H2,1H3,(H,16,18)