ethyl 4-(phenylcarbamoyl)-4-[propyl-[(E)-3-thiophen-2-ylprop-2-enoyl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-(phenylcarbamoyl)-4-[propyl-[(E)-3-thiophen-2-ylprop-2-enoyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-(phenylcarbamoyl)-4-[propyl-[(E)-3-(2-thienyl)prop-2-enoyl]amino]piperidine-1-carboxylate CAS Name: 4-[anilino(oxo)methyl]-4-[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]-propylamino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(phenylcarbamoyl)-4-[propyl-[(E)-3-thiophen-2-ylprop-2-enoyl]amino]piperidine-1-carboxylate Traditional Name: 4-(phenylcarbamoyl)-4-[propyl-[(E)-3-(2-thienyl)acryloyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(=O)C=CC1=CC=CS1)C2(CCN(CC2)C(=O)OCC)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCN(C(=O)/C=C/C1=CC=CS1)C2(CCN(CC2)C(=O)OCC)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C25H31N3O4S/c1-3-16-28(22(29)13-12-21-11-8-19-33-21)25(23(30)26-20-9-6-5-7-10-20)14-17-27(18-15-25)24(31)32-4-2/h5-13,19H,3-4,14-18H2,1-2H3,(H,26,30)/b13-12+