4-[3-[4-(butanoylamino)phenyl]sulfanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzamide

Systemtic Name: 4-[3-[4-(butanoylamino)phenyl]sulfanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzamide Openeye Name: 4-[3-[4-(butanoylamino)phenyl]sulfanyl-2,5-dioxo-pyrrolidin-1-yl]benzamide CAS Name: 4-[2,5-dioxo-3-[[4-(1-oxobutylamino)phenyl]thio]-1-pyrrolidinyl]benzamide IUPAC Name: 4-[3-[4-(butanoylamino)phenyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]benzamide Traditional Name: 4-[3-[(4-butyramidophenyl)thio]-2,5-diketo-pyrrolidino]benzamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C21H21N3O4S/c1-2-3-18(25)23-14-6-10-16(11-7-14)29-17-12-19(26)24(21(17)28)15-8-4-13(5-9-15)20(22)27/h4-11,17H,2-3,12H2,1H3,(H2,22,27)(H,23,25)