2-[[(E)-3-(5-bromanylthiophen-2-yl)prop-2-enoyl]amino]-N-(3-methylphenyl)benzamide

Systemtic Name: 2-[[(E)-3-(5-bromanylthiophen-2-yl)prop-2-enoyl]amino]-N-(3-methylphenyl)benzamide Openeye Name: 2-[[(E)-3-(5-bromo-2-thienyl)prop-2-enoyl]amino]-N-(m-tolyl)benzamide CAS Name: 2-[[(E)-3-(5-bromo-2-thiophenyl)-1-oxoprop-2-enyl]amino]-N-(3-methylphenyl)benzamide IUPAC Name: 2-[[(E)-3-(5-bromothiophen-2-yl)prop-2-enoyl]amino]-N-(3-methylphenyl)benzamide Traditional Name: 2-[[(E)-3-(5-bromo-2-thienyl)acryloyl]amino]-N-(m-tolyl)benzamide Formula: C21H17BrN2O2S MolecularWeight: 441.34088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)C=CC3=CC=C(S3)Br

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)/C=C/C3=CC=C(S3)Br

InChI

InChI=1S/C21H17BrN2O2S/c1-14-5-4-6-15(13-14)23-21(26)17-7-2-3-8-18(17)24-20(25)12-10-16-9-11-19(22)27-16/h2-13H,1H3,(H,23,26)(H,24,25)/b12-10+