N-[3-[2-azanyl-3,4-bis(oxidanylidene)cyclobuten-1-yl]phenyl]-3-(quinolin-4-ylmethylamino)thiophene-2-carboxamide

Systemtic Name: N-[3-[2-azanyl-3,4-bis(oxidanylidene)cyclobuten-1-yl]phenyl]-3-(quinolin-4-ylmethylamino)thiophene-2-carboxamide Openeye Name: N-[3-(2-amino-3,4-dioxo-cyclobuten-1-yl)phenyl]-3-(4-quinolylmethylamino)thiophene-2-carboxamide CAS Name: N-[3-(2-amino-3,4-dioxo-1-cyclobutenyl)phenyl]-3-(4-quinolinylmethylamino)-2-thiophenecarboxamide IUPAC Name: N-[3-(2-amino-3,4-dioxocyclobuten-1-yl)phenyl]-3-(quinolin-4-ylmethylamino)thiophene-2-carboxamide Traditional Name: N-[3-(2-amino-3,4-diketo-cyclobuten-1-yl)phenyl]-3-(4-quinolylmethylamino)thiophene-2-carboxamide Formula: C25H18N4O3S MolecularWeight: 454.50042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)CNC3=C(SC=C3)C(=O)NC4=CC=CC(=C4)C5=C(C(=O)C5=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)CNC3=C(SC=C3)C(=O)NC4=CC=CC(=C4)C5=C(C(=O)C5=O)N

InChI

InChI=1S/C25H18N4O3S/c26-21-20(22(30)23(21)31)14-4-3-5-16(12-14)29-25(32)24-19(9-11-33-24)28-13-15-8-10-27-18-7-2-1-6-17(15)18/h1-12,28H,13,26H2,(H,29,32)