5-[[3,4-bis(oxidanylidene)-2-sulfanyl-cyclobuten-1-yl]amino]-N-phenyl-pentanamide

Systemtic Name: 5-[[3,4-bis(oxidanylidene)-2-sulfanyl-cyclobuten-1-yl]amino]-N-phenyl-pentanamide Openeye Name: 5-[(3,4-dioxo-2-sulfanyl-cyclobuten-1-yl)amino]-N-phenyl-pentanamide CAS Name: 5-[(2-mercapto-3,4-dioxo-1-cyclobutenyl)amino]-N-phenylpentanamide IUPAC Name: 5-[(3,4-dioxo-2-sulfanylcyclobuten-1-yl)amino]-N-phenylpentanamide Traditional Name: 5-[(3,4-diketo-2-mercapto-cyclobuten-1-yl)amino]-N-phenyl-valeramide Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCCCNC2=C(C(=O)C2=O)S

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CCCCNC2=C(C(=O)C2=O)S

InChI

InChI=1S/C15H16N2O3S/c18-11(17-10-6-2-1-3-7-10)8-4-5-9-16-12-13(19)14(20)15(12)21/h1-3,6-7,16,21H,4-5,8-9H2,(H,17,18)