6-[[3,4-bis(oxidanylidene)-2-sulfanyl-cyclobuten-1-yl]amino]-N-phenyl-hexanamide

Systemtic Name: 6-[[3,4-bis(oxidanylidene)-2-sulfanyl-cyclobuten-1-yl]amino]-N-phenyl-hexanamide Openeye Name: 6-[(3,4-dioxo-2-sulfanyl-cyclobuten-1-yl)amino]-N-phenyl-hexanamide CAS Name: 6-[(2-mercapto-3,4-dioxo-1-cyclobutenyl)amino]-N-phenylhexanamide IUPAC Name: 6-[(3,4-dioxo-2-sulfanylcyclobuten-1-yl)amino]-N-phenylhexanamide Traditional Name: 6-[(3,4-diketo-2-mercapto-cyclobuten-1-yl)amino]-N-phenyl-hexanamide Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCCCCNC2=C(C(=O)C2=O)S

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CCCCCNC2=C(C(=O)C2=O)S

InChI

InChI=1S/C16H18N2O3S/c19-12(18-11-7-3-1-4-8-11)9-5-2-6-10-17-13-14(20)15(21)16(13)22/h1,3-4,7-8,17,22H,2,5-6,9-10H2,(H,18,19)