N-[(Z)-3-(azocan-1-yl)-3-oxidanylidene-1-thiophen-2-yl-prop-1-en-2-yl]-3,4-dimethyl-benzamide

Systemtic Name: N-[(Z)-3-(azocan-1-yl)-3-oxidanylidene-1-thiophen-2-yl-prop-1-en-2-yl]-3,4-dimethyl-benzamide Openeye Name: N-[(Z)-1-(azocane-1-carbonyl)-2-(2-thienyl)vinyl]-3,4-dimethyl-benzamide CAS Name: N-[(Z)-3-(1-azocanyl)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]-3,4-dimethylbenzamide IUPAC Name: N-[(Z)-3-(azocan-1-yl)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]-3,4-dimethylbenzamide Traditional Name: N-[(Z)-1-(azocane-1-carbonyl)-2-(2-thienyl)vinyl]-3,4-dimethyl-benzamide Formula: C23H28N2O2S MolecularWeight: 396.54562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=CC2=CC=CS2)C(=O)N3CCCCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N/C(=C\C2=CC=CS2)/C(=O)N3CCCCCCC3)C

InChI

InChI=1S/C23H28N2O2S/c1-17-10-11-19(15-18(17)2)22(26)24-21(16-20-9-8-14-28-20)23(27)25-12-6-4-3-5-7-13-25/h8-11,14-16H,3-7,12-13H2,1-2H3,(H,24,26)/b21-16-