(E)-N-[[4-(4-methylpiperidin-1-yl)carbonylphenyl]carbamothioyl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[[4-(4-methylpiperidin-1-yl)carbonylphenyl]carbamothioyl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[[4-(4-methylpiperidine-1-carbonyl)phenyl]carbamothioyl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[[4-[(4-methyl-1-piperidinyl)-oxomethyl]anilino]-sulfanylidenemethyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[[4-(4-methylpiperidine-1-carbonyl)phenyl]carbamothioyl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[[4-(4-methylpiperidine-1-carbonyl)phenyl]thiocarbamoyl]-3-(2-thienyl)acrylamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC=CS3

Isomeric SMILES

CC1CCN(CC1)C(=O)C2=CC=C(C=C2)NC(=S)NC(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C21H23N3O2S2/c1-15-10-12-24(13-11-15)20(26)16-4-6-17(7-5-16)22-21(27)23-19(25)9-8-18-3-2-14-28-18/h2-9,14-15H,10-13H2,1H3,(H2,22,23,25,27)/b9-8+