4-methyl-N-[(Z)-1-(3-methylthiophen-2-yl)-3-oxidanylidene-3-(pyridin-3-ylmethylamino)prop-1-en-2-yl]benzamide

Systemtic Name: 4-methyl-N-[(Z)-1-(3-methylthiophen-2-yl)-3-oxidanylidene-3-(pyridin-3-ylmethylamino)prop-1-en-2-yl]benzamide Openeye Name: 4-methyl-N-[(Z)-2-(3-methyl-2-thienyl)-1-(3-pyridylmethylcarbamoyl)vinyl]benzamide CAS Name: 4-methyl-N-[(Z)-1-(3-methyl-2-thiophenyl)-3-oxo-3-(3-pyridinylmethylamino)prop-1-en-2-yl]benzamide IUPAC Name: 4-methyl-N-[(Z)-1-(3-methylthiophen-2-yl)-3-oxo-3-(pyridin-3-ylmethylamino)prop-1-en-2-yl]benzamide Traditional Name: 4-methyl-N-[(Z)-2-(3-methyl-2-thienyl)-1-(3-pyridylmethylcarbamoyl)vinyl]benzamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=CC2=C(C=CS2)C)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/C(=C\C2=C(C=CS2)C)/C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C22H21N3O2S/c1-15-5-7-18(8-6-15)21(26)25-19(12-20-16(2)9-11-28-20)22(27)24-14-17-4-3-10-23-13-17/h3-13H,14H2,1-2H3,(H,24,27)(H,25,26)/b19-12-