(E)-3-(1,3-benzothiazol-2-yl)-1-(4-cyclopropylcarbonylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(1,3-benzothiazol-2-yl)-1-(4-cyclopropylcarbonylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(1,3-benzothiazol-2-yl)-1-[4-(cyclopropanecarbonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-1-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(1,3-benzothiazol-2-yl)-1-[4-(cyclopropanecarbonyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)-1-[4-(cyclopropanecarbonyl)piperazino]prop-2-en-1-one Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCN(CC2)C(=O)C=CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC1C(=O)N2CCN(CC2)C(=O)/C=C/C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H19N3O2S/c22-17(8-7-16-19-14-3-1-2-4-15(14)24-16)20-9-11-21(12-10-20)18(23)13-5-6-13/h1-4,7-8,13H,5-6,9-12H2/b8-7+