3-(1H-indol-5-yl)-1-(3-thiophen-2-ylphenyl)prop-2-yn-1-one

Systemtic Name: 3-(1H-indol-5-yl)-1-(3-thiophen-2-ylphenyl)prop-2-yn-1-one Openeye Name: 3-(1H-indol-5-yl)-1-[3-(2-thienyl)phenyl]prop-2-yn-1-one CAS Name: 3-(1H-indol-5-yl)-1-(3-thiophen-2-ylphenyl)-2-propyn-1-one IUPAC Name: 3-(1H-indol-5-yl)-1-(3-thiophen-2-ylphenyl)prop-2-yn-1-one Traditional Name: 3-(1H-indol-5-yl)-1-[3-(2-thienyl)phenyl]prop-2-yn-1-one Formula: C21H13NOS MolecularWeight: 327.39902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)C#CC2=CC3=C(C=C2)NC=C3)C4=CC=CS4

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)C#CC2=CC3=C(C=C2)NC=C3)C4=CC=CS4

InChI

InChI=1S/C21H13NOS/c23-20(9-7-15-6-8-19-16(13-15)10-11-22-19)17-3-1-4-18(14-17)21-5-2-12-24-21/h1-6,8,10-14,22H