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

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[(3-cyclopentyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-2-phenyl-ethanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-[(3-cyclopentyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)sulfanyl]-2-phenyl-acetamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[(3-cyclopentyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]-2-phenylacetamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-[(3-cyclopentyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-2-phenylacetamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-[(3-cyclopentyl-4-keto-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)thio]-2-phenyl-acetamide Formula: C30H30ClN3O2S2 MolecularWeight: 564.1611

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=NC4=C(C5=C(S4)CCCC5)C(=O)N3C6CCCC6)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=NC4=C(C5=C(S4)CCCC5)C(=O)N3C6CCCC6)Cl

InChI

InChI=1S/C30H30ClN3O2S2/c1-18-15-16-20(17-23(18)31)32-27(35)26(19-9-3-2-4-10-19)38-30-33-28-25(22-13-7-8-14-24(22)37-28)29(36)34(30)21-11-5-6-12-21/h2-4,9-10,15-17,21,26H,5-8,11-14H2,1H3,(H,32,35)