3-azanyl-N-[3-[5-[2-[2-(oxidanylamino)-2-oxidanylidene-ethyl]-1,1-bis(oxidanylidene)thian-2-yl]thiophen-2-yl]phenyl]propanamide

Systemtic Name: 3-azanyl-N-[3-[5-[2-[2-(oxidanylamino)-2-oxidanylidene-ethyl]-1,1-bis(oxidanylidene)thian-2-yl]thiophen-2-yl]phenyl]propanamide Openeye Name: 3-amino-N-[3-[5-[2-[2-(hydroxyamino)-2-oxo-ethyl]-1,1-dioxo-thian-2-yl]-2-thienyl]phenyl]propanamide CAS Name: 3-amino-N-[3-[5-[2-[2-(hydroxyamino)-2-oxoethyl]-1,1-dioxo-2-thianyl]-2-thiophenyl]phenyl]propanamide IUPAC Name: 3-amino-N-[3-[5-[2-[2-(hydroxyamino)-2-oxoethyl]-1,1-dioxothian-2-yl]thiophen-2-yl]phenyl]propanamide Traditional Name: 3-amino-N-[3-[5-[2-[2-(hydroxyamino)-2-keto-ethyl]-1,1-diketo-thian-2-yl]-2-thienyl]phenyl]propionamide Formula: C20H25N3O5S2 MolecularWeight: 451.5596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCS(=O)(=O)C(C1)(CC(=O)NO)C2=CC=C(S2)C3=CC(=CC=C3)NC(=O)CCN

Isomeric SMILES

C1CCS(=O)(=O)C(C1)(CC(=O)NO)C2=CC=C(S2)C3=CC(=CC=C3)NC(=O)CCN

InChI

InChI=1S/C20H25N3O5S2/c21-10-8-18(24)22-15-5-3-4-14(12-15)16-6-7-17(29-16)20(13-19(25)23-26)9-1-2-11-30(20,27)28/h3-7,12,26H,1-2,8-11,13,21H2,(H,22,24)(H,23,25)