N-(oxolan-2-ylmethyl)-5-(2-phenylsulfanylethanoylamino)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(oxolan-2-ylmethyl)-5-(2-phenylsulfanylethanoylamino)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(2-phenylsulfanylacetyl)amino]-2-pyrrolidin-1-yl-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: N-(2-oxolanylmethyl)-5-[[1-oxo-2-(phenylthio)ethyl]amino]-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-(oxolan-2-ylmethyl)-5-[(2-phenylsulfanylacetyl)amino]-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[[2-(phenylthio)acetyl]amino]-2-pyrrolidino-N-(tetrahydrofurfuryl)benzamide Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)NC(=O)CSC3=CC=CC=C3)C(=O)NCC4CCCO4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)NC(=O)CSC3=CC=CC=C3)C(=O)NCC4CCCO4

InChI

InChI=1S/C24H29N3O3S/c28-23(17-31-20-8-2-1-3-9-20)26-18-10-11-22(27-12-4-5-13-27)21(15-18)24(29)25-16-19-7-6-14-30-19/h1-3,8-11,15,19H,4-7,12-14,16-17H2,(H,25,29)(H,26,28)