ethyl 7-(4-azido-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-cyclopropyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 7-(4-azido-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-cyclopropyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 7-(4-azido-5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-cyclopropyl-8-methoxy-4-oxo-quinoline-3-carboxylate CAS Name: 7-(4-azido-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-cyclopropyl-8-methoxy-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-(4-azido-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-cyclopropyl-8-methoxy-4-oxoquinoline-3-carboxylate Traditional Name: 7-(4-azido-5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-cyclopropyl-4-keto-8-methoxy-quinoline-3-carboxylic acid ethyl ester Formula: C25H26N4O4S MolecularWeight: 478.56334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C1=O)C=CC(=C2OC)C3=CC4=C(S3)CCC(C4N=[N+]=[N-])C)C5CC5

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C1=O)C=CC(=C2OC)C3=CC4=C(S3)CCC(C4N=[N+]=[N-])C)C5CC5

InChI

InChI=1S/C25H26N4O4S/c1-4-33-25(31)18-12-29(14-6-7-14)22-16(23(18)30)9-8-15(24(22)32-3)20-11-17-19(34-20)10-5-13(2)21(17)27-28-26/h8-9,11-14,21H,4-7,10H2,1-3H3