3-[[(E)-3-(5-bromanylthiophen-2-yl)prop-2-enoyl]-(phenylmethyl)amino]propanamide

Systemtic Name: 3-[[(E)-3-(5-bromanylthiophen-2-yl)prop-2-enoyl]-(phenylmethyl)amino]propanamide Openeye Name: 3-[benzyl-[(E)-3-(5-bromo-2-thienyl)prop-2-enoyl]amino]propanamide CAS Name: 3-[[(E)-3-(5-bromo-2-thiophenyl)-1-oxoprop-2-enyl]-(phenylmethyl)amino]propanamide IUPAC Name: 3-[benzyl-[(E)-3-(5-bromothiophen-2-yl)prop-2-enoyl]amino]propanamide Traditional Name: 3-[benzyl-[(E)-3-(5-bromo-2-thienyl)acryloyl]amino]propionamide Formula: C17H17BrN2O2S MolecularWeight: 393.29808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC(=O)N)C(=O)C=CC2=CC=C(S2)Br

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC(=O)N)C(=O)/C=C/C2=CC=C(S2)Br

InChI

InChI=1S/C17H17BrN2O2S/c18-15-8-6-14(23-15)7-9-17(22)20(11-10-16(19)21)12-13-4-2-1-3-5-13/h1-9H,10-12H2,(H2,19,21)/b9-7+