N-[3,5-bis(chloranyl)phenyl]-2-[(7-methyl-4-oxidanylidene-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]propanamide

Systemtic Name: N-[3,5-bis(chloranyl)phenyl]-2-[(7-methyl-4-oxidanylidene-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: 2-[(3-allyl-7-methyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(3,5-dichlorophenyl)propanamide CAS Name: N-(3,5-dichlorophenyl)-2-[(7-methyl-4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]propanamide IUPAC Name: N-(3,5-dichlorophenyl)-2-[(7-methyl-4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: 2-[(3-allyl-4-keto-7-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)thio]-N-(3,5-dichlorophenyl)propionamide Formula: C23H23Cl2N3O2S2 MolecularWeight: 508.48362

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SC(C)C(=O)NC4=CC(=CC(=C4)Cl)Cl)CC=C

Isomeric SMILES

CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SC(C)C(=O)NC4=CC(=CC(=C4)Cl)Cl)CC=C

InChI

InChI=1S/C23H23Cl2N3O2S2/c1-4-7-28-22(30)19-17-6-5-12(2)8-18(17)32-21(19)27-23(28)31-13(3)20(29)26-16-10-14(24)9-15(25)11-16/h4,9-13H,1,5-8H2,2-3H3,(H,26,29)