7-bromanyl-4-oxidanylidene-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)chromene-2-carboxamide

Systemtic Name: 7-bromanyl-4-oxidanylidene-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)chromene-2-carboxamide Openeye Name: 7-bromo-4-oxo-N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]chromene-2-carboxamide CAS Name: 7-bromo-4-oxo-N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]-1-benzopyran-2-carboxamide IUPAC Name: 7-bromo-4-oxo-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)chromene-2-carboxamide Traditional Name: 7-bromo-4-keto-N-[2-pyrrolidino-2-(2-thienyl)ethyl]chromene-2-carboxamide Formula: C20H19BrN2O3S MolecularWeight: 447.34546

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2=CC(=O)C3=C(O2)C=C(C=C3)Br)C4=CC=CS4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2=CC(=O)C3=C(O2)C=C(C=C3)Br)C4=CC=CS4

InChI

InChI=1S/C20H19BrN2O3S/c21-13-5-6-14-16(24)11-18(26-17(14)10-13)20(25)22-12-15(19-4-3-9-27-19)23-7-1-2-8-23/h3-6,9-11,15H,1-2,7-8,12H2,(H,22,25)