9-oxidanylidene-4-phenylazanyl-8-(2-thiophen-2-ylethanoylamino)-6-thia-1,3-diazabicyclo[5.2.0]non-3-ene-2-carboxylic acid

Systemtic Name: 9-oxidanylidene-4-phenylazanyl-8-(2-thiophen-2-ylethanoylamino)-6-thia-1,3-diazabicyclo[5.2.0]non-3-ene-2-carboxylic acid Openeye Name: 4-anilino-9-oxo-8-[[2-(2-thienyl)acetyl]amino]-6-thia-1,3-diazabicyclo[5.2.0]non-3-ene-2-carboxylic acid CAS Name: 4-anilino-9-oxo-8-[(1-oxo-2-thiophen-2-ylethyl)amino]-6-thia-1,3-diazabicyclo[5.2.0]non-3-ene-2-carboxylic acid IUPAC Name: 4-anilino-9-oxo-8-[(2-thiophen-2-ylacetyl)amino]-6-thia-1,3-diazabicyclo[5.2.0]non-3-ene-2-carboxylic acid Traditional Name: 4-anilino-9-keto-8-[[2-(2-thienyl)acetyl]amino]-6-thia-1,3-diazabicyclo[5.2.0]non-3-ene-2-carboxylic acid Formula: C19H18N4O4S2 MolecularWeight: 430.50062

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC(N2C(S1)C(C2=O)NC(=O)CC3=CC=CS3)C(=O)O)NC4=CC=CC=C4

Isomeric SMILES

C1C(=NC(N2C(S1)C(C2=O)NC(=O)CC3=CC=CS3)C(=O)O)NC4=CC=CC=C4

InChI

InChI=1S/C19H18N4O4S2/c24-14(9-12-7-4-8-28-12)22-15-17(25)23-16(19(26)27)21-13(10-29-18(15)23)20-11-5-2-1-3-6-11/h1-8,15-16,18H,9-10H2,(H,20,21)(H,22,24)(H,26,27)