2-[(4-azanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[2,6-bis(chloranyl)phenyl]ethanamide

Systemtic Name: 2-[(4-azanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[2,6-bis(chloranyl)phenyl]ethanamide Openeye Name: 2-[(4-amino-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(2,6-dichlorophenyl)acetamide CAS Name: 2-[(4-amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]-N-(2,6-dichlorophenyl)acetamide IUPAC Name: 2-[(4-amino-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(2,6-dichlorophenyl)acetamide Traditional Name: 2-[(4-amino-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)thio]-N-(2,6-dichlorophenyl)acetamide Formula: C18H16Cl2N4OS2 MolecularWeight: 439.38184

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(N=C(N=C3S2)SCC(=O)NC4=C(C=CC=C4Cl)Cl)N

Isomeric SMILES

C1CCC2=C(C1)C3=C(N=C(N=C3S2)SCC(=O)NC4=C(C=CC=C4Cl)Cl)N

InChI

InChI=1S/C18H16Cl2N4OS2/c19-10-5-3-6-11(20)15(10)22-13(25)8-26-18-23-16(21)14-9-4-1-2-7-12(9)27-17(14)24-18/h3,5-6H,1-2,4,7-8H2,(H,22,25)(H2,21,23,24)