2-[[(E)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enoyl]amino]propanediamide

Systemtic Name: 2-[[(E)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enoyl]amino]propanediamide Openeye Name: 2-[[(E)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]prop-2-enoyl]amino]propanediamide CAS Name: 2-[[(E)-1-oxo-3-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)prop-2-enyl]amino]propanediamide IUPAC Name: 2-[[(E)-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enoyl]amino]propanediamide Traditional Name: 2-[[(E)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]acryloyl]amino]malonamide Formula: C19H17N5O3S MolecularWeight: 395.43498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C=CC(=O)NC(C(=O)N)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)/C=C/C(=O)NC(C(=O)N)C(=O)N

InChI

InChI=1S/C19H17N5O3S/c20-18(26)17(19(21)27)22-15(25)9-8-12-11-24(13-5-2-1-3-6-13)23-16(12)14-7-4-10-28-14/h1-11,17H,(H2,20,26)(H2,21,27)(H,22,25)/b9-8+