4-methyl-N-[(Z)-1-(3-methylthiophen-2-yl)-3-(3-morpholin-4-ium-4-ylpropylamino)-3-oxidanylidene-prop-1-en-2-yl]benzamide

Systemtic Name: 4-methyl-N-[(Z)-1-(3-methylthiophen-2-yl)-3-(3-morpholin-4-ium-4-ylpropylamino)-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: 4-methyl-N-[(Z)-2-(3-methyl-2-thienyl)-1-(3-morpholin-4-ium-4-ylpropylcarbamoyl)vinyl]benzamide CAS Name: 4-methyl-N-[(Z)-1-(3-methyl-2-thiophenyl)-3-[3-(4-morpholin-4-iumyl)propylamino]-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: 4-methyl-N-[(Z)-1-(3-methylthiophen-2-yl)-3-(3-morpholin-4-ium-4-ylpropylamino)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: 4-methyl-N-[(Z)-2-(3-methyl-2-thienyl)-1-(3-morpholin-4-ium-4-ylpropylcarbamoyl)vinyl]benzamide Formula: C23H30N3O3S+ MolecularWeight: 428.5676

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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)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/C(=C\C2=C(C=CS2)C)/C(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C23H29N3O3S/c1-17-4-6-19(7-5-17)22(27)25-20(16-21-18(2)8-15-30-21)23(28)24-9-3-10-26-11-13-29-14-12-26/h4-8,15-16H,3,9-14H2,1-2H3,(H,24,28)(H,25,27)/p+1/b20-16-