N-phenanthro[9,10-b]quinoxalin-11-ylpyrrolidine-1-carbothioamide

Systemtic Name: N-phenanthro[9,10-b]quinoxalin-11-ylpyrrolidine-1-carbothioamide Openeye Name: N-phenanthro[9,10-b]quinoxalin-11-ylpyrrolidine-1-carbothioamide CAS Name: N-(11-phenanthro[9,10-b]quinoxalinyl)-1-pyrrolidinecarbothioamide IUPAC Name: N-phenanthro[9,10-b]quinoxalin-11-ylpyrrolidine-1-carbothioamide Traditional Name: N-phenanthro[9,10-b]quinoxalin-11-ylpyrrolidine-1-carbothioamide Formula: C25H20N4S MolecularWeight: 408.5181

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)NC2=CC3=C(C=C2)N=C4C5=CC=CC=C5C6=CC=CC=C6C4=N3

Isomeric SMILES

C1CCN(C1)C(=S)NC2=CC3=C(C=C2)N=C4C5=CC=CC=C5C6=CC=CC=C6C4=N3

InChI

InChI=1S/C25H20N4S/c30-25(29-13-5-6-14-29)26-16-11-12-21-22(15-16)28-24-20-10-4-2-8-18(20)17-7-1-3-9-19(17)23(24)27-21/h1-4,7-12,15H,5-6,13-14H2,(H,26,30)