5-[[4-(4-methylphenyl)sulfonyl-5-pyrrolidin-1-yl-1,3-oxazol-2-yl]methylidene]-3-(3-phenylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[[4-(4-methylphenyl)sulfonyl-5-pyrrolidin-1-yl-1,3-oxazol-2-yl]methylidene]-3-(3-phenylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 3-(3-phenylpropyl)-5-[[4-(p-tolylsulfonyl)-5-pyrrolidin-1-yl-oxazol-2-yl]methylene]-2-thioxo-thiazolidin-4-one CAS Name: 5-[[4-(4-methylphenyl)sulfonyl-5-(1-pyrrolidinyl)-2-oxazolyl]methylidene]-3-(3-phenylpropyl)-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[[4-(4-methylphenyl)sulfonyl-5-pyrrolidin-1-yl-1,3-oxazol-2-yl]methylidene]-3-(3-phenylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-(3-phenylpropyl)-5-[(5-pyrrolidino-4-tosyl-oxazol-2-yl)methylene]-2-thioxo-thiazolidin-4-one Formula: C27H27N3O4S3 MolecularWeight: 553.71598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C=C3C(=O)N(C(=S)S3)CCCC4=CC=CC=C4)N5CCCC5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C=C3C(=O)N(C(=S)S3)CCCC4=CC=CC=C4)N5CCCC5

InChI

InChI=1S/C27H27N3O4S3/c1-19-11-13-21(14-12-19)37(32,33)24-26(29-15-5-6-16-29)34-23(28-24)18-22-25(31)30(27(35)36-22)17-7-10-20-8-3-2-4-9-20/h2-4,8-9,11-14,18H,5-7,10,15-17H2,1H3