2-[[(E)-3-(1,3-benzothiazol-2-yl)prop-2-enoyl]amino]-N-(1-phenylethyl)benzamide

Systemtic Name: 2-[[(E)-3-(1,3-benzothiazol-2-yl)prop-2-enoyl]amino]-N-(1-phenylethyl)benzamide Openeye Name: 2-[[(E)-3-(1,3-benzothiazol-2-yl)prop-2-enoyl]amino]-N-(1-phenylethyl)benzamide CAS Name: 2-[[(E)-3-(1,3-benzothiazol-2-yl)-1-oxoprop-2-enyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: 2-[[(E)-3-(1,3-benzothiazol-2-yl)prop-2-enoyl]amino]-N-(1-phenylethyl)benzamide Traditional Name: 2-[[(E)-3-(1,3-benzothiazol-2-yl)acryloyl]amino]-N-(1-phenylethyl)benzamide Formula: C25H21N3O2S MolecularWeight: 427.51814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)C=CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)/C=C/C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H21N3O2S/c1-17(18-9-3-2-4-10-18)26-25(30)19-11-5-6-12-20(19)27-23(29)15-16-24-28-21-13-7-8-14-22(21)31-24/h2-17H,1H3,(H,26,30)(H,27,29)/b16-15+