2-[[4-[(E)-3-(4-thiophen-2-ylphenyl)prop-2-enoyl]phenyl]carbamoylamino]ethanoic acid

Systemtic Name: 2-[[4-[(E)-3-(4-thiophen-2-ylphenyl)prop-2-enoyl]phenyl]carbamoylamino]ethanoic acid Openeye Name: 2-[[4-[(E)-3-[4-(2-thienyl)phenyl]prop-2-enoyl]phenyl]carbamoylamino]acetic acid CAS Name: 2-[[oxo-[4-[(E)-1-oxo-3-(4-thiophen-2-ylphenyl)prop-2-enyl]anilino]methyl]amino]acetic acid IUPAC Name: 2-[[4-[(E)-3-(4-thiophen-2-ylphenyl)prop-2-enoyl]phenyl]carbamoylamino]acetic acid Traditional Name: 2-[[4-[(E)-3-[4-(2-thienyl)phenyl]acryloyl]phenyl]carbamoylamino]acetic acid Formula: C22H18N2O4S MolecularWeight: 406.45432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC=C(C=C2)C=CC(=O)C3=CC=C(C=C3)NC(=O)NCC(=O)O

Isomeric SMILES

C1=CSC(=C1)C2=CC=C(C=C2)/C=C/C(=O)C3=CC=C(C=C3)NC(=O)NCC(=O)O

InChI

InChI=1S/C22H18N2O4S/c25-19(12-5-15-3-6-17(7-4-15)20-2-1-13-29-20)16-8-10-18(11-9-16)24-22(28)23-14-21(26)27/h1-13H,14H2,(H,26,27)(H2,23,24,28)/b12-5+