ethyl 4-[(Z)-2-benzamido-3-thiophen-2-yl-prop-2-enoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(Z)-2-benzamido-3-thiophen-2-yl-prop-2-enoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(Z)-2-benzamido-3-(2-thienyl)prop-2-enoyl]piperazine-1-carboxylate CAS Name: 4-[(Z)-2-benzamido-1-oxo-3-thiophen-2-ylprop-2-enyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(Z)-2-benzamido-3-thiophen-2-ylprop-2-enoyl]piperazine-1-carboxylate Traditional Name: 4-[(Z)-2-benzamido-3-(2-thienyl)acryloyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(=CC2=CC=CS2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)/C(=C/C2=CC=CS2)/NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O4S/c1-2-28-21(27)24-12-10-23(11-13-24)20(26)18(15-17-9-6-14-29-17)22-19(25)16-7-4-3-5-8-16/h3-9,14-15H,2,10-13H2,1H3,(H,22,25)/b18-15-