7-[[3,4-bis(oxidanylidene)-2-sulfanyl-cyclobuten-1-yl]amino]-N-phenyl-heptanamide

Systemtic Name: 7-[[3,4-bis(oxidanylidene)-2-sulfanyl-cyclobuten-1-yl]amino]-N-phenyl-heptanamide Openeye Name: 7-[(3,4-dioxo-2-sulfanyl-cyclobuten-1-yl)amino]-N-phenyl-heptanamide CAS Name: 7-[(2-mercapto-3,4-dioxo-1-cyclobutenyl)amino]-N-phenylheptanamide IUPAC Name: 7-[(3,4-dioxo-2-sulfanylcyclobuten-1-yl)amino]-N-phenylheptanamide Traditional Name: 7-[(3,4-diketo-2-mercapto-cyclobuten-1-yl)amino]-N-phenyl-enanthamide Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCCCCCNC2=C(C(=O)C2=O)S

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CCCCCCNC2=C(C(=O)C2=O)S

InChI

InChI=1S/C17H20N2O3S/c20-13(19-12-8-4-3-5-9-12)10-6-1-2-7-11-18-14-15(21)16(22)17(14)23/h3-5,8-9,18,23H,1-2,6-7,10-11H2,(H,19,20)