N-[(2,4-dichlorophenyl)methyl]-2-[(4-oxidanylidene-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[(2,4-dichlorophenyl)methyl]-2-[(4-oxidanylidene-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-[(2,4-dichlorophenyl)methyl]-2-[(4-oxo-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-[(2,4-dichlorophenyl)methyl]-2-[(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]acetamide IUPAC Name: N-[(2,4-dichlorophenyl)methyl]-2-[(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-(2,4-dichlorobenzyl)-2-[(4-keto-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C19H17Cl2N3O2S2 MolecularWeight: 454.39318

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)SCC(=O)NCC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)SCC(=O)NCC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C19H17Cl2N3O2S2/c20-11-6-5-10(13(21)7-11)8-22-15(25)9-27-19-23-17(26)16-12-3-1-2-4-14(12)28-18(16)24-19/h5-7H,1-4,8-9H2,(H,22,25)(H,23,24,26)