3-chloranyl-N-phenanthren-9-yl-benzo[g][1]benzothiole-2-carboxamide

Systemtic Name: 3-chloranyl-N-phenanthren-9-yl-benzo[g][1]benzothiole-2-carboxamide Openeye Name: 3-chloro-N-(9-phenanthryl)benzo[g]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-(9-phenanthrenyl)-2-benzo[g][1]benzothiolecarboxamide IUPAC Name: 3-chloro-N-phenanthren-9-ylbenzo[g][1]benzothiole-2-carboxamide Traditional Name: 3-chloro-N-(9-phenanthryl)benzo[g]benzothiophene-2-carboxamide Formula: C27H16ClNOS MolecularWeight: 437.94004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2SC(=C3Cl)C(=O)NC4=CC5=CC=CC=C5C6=CC=CC=C64

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2SC(=C3Cl)C(=O)NC4=CC5=CC=CC=C5C6=CC=CC=C64

InChI

InChI=1S/C27H16ClNOS/c28-24-22-14-13-16-7-1-4-10-19(16)25(22)31-26(24)27(30)29-23-15-17-8-2-3-9-18(17)20-11-5-6-12-21(20)23/h1-15H,(H,29,30)