ethyl 4-[(E)-3-(1,3-benzothiazol-2-yl)prop-2-enoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(E)-3-(1,3-benzothiazol-2-yl)prop-2-enoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(E)-3-(1,3-benzothiazol-2-yl)prop-2-enoyl]piperazine-1-carboxylate CAS Name: 4-[(E)-3-(1,3-benzothiazol-2-yl)-1-oxoprop-2-enyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-3-(1,3-benzothiazol-2-yl)prop-2-enoyl]piperazine-1-carboxylate Traditional Name: 4-[(E)-3-(1,3-benzothiazol-2-yl)acryloyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C=CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)/C=C/C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H19N3O3S/c1-2-23-17(22)20-11-9-19(10-12-20)16(21)8-7-15-18-13-5-3-4-6-14(13)24-15/h3-8H,2,9-12H2,1H3/b8-7+