(E)-3-(4-methoxyphenyl)-1-[4-(5-nitro-1,3-thiazol-2-yl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-methoxyphenyl)-1-[4-(5-nitro-1,3-thiazol-2-yl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-methoxyphenyl)-1-[4-(5-nitrothiazol-2-yl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(4-methoxyphenyl)-1-[4-(5-nitro-2-thiazolyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-methoxyphenyl)-1-[4-(5-nitro-1,3-thiazol-2-yl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(4-methoxyphenyl)-1-[4-(5-nitrothiazol-2-yl)piperazino]prop-2-en-1-one Formula: C17H18N4O4S MolecularWeight: 374.41422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)C3=NC=C(S3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)C3=NC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O4S/c1-25-14-5-2-13(3-6-14)4-7-15(22)19-8-10-20(11-9-19)17-18-12-16(26-17)21(23)24/h2-7,12H,8-11H2,1H3/b7-4+