3-[5-[4-[(E)-diazanylidenemethyl]phenyl]pentanoylamino]-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-[5-[4-[(E)-diazanylidenemethyl]phenyl]pentanoylamino]-3-thiophen-2-yl-propanoic acid Openeye Name: 3-[5-[4-[(E)-hydrazinylidenemethyl]phenyl]pentanoylamino]-3-(2-thienyl)propanoic acid CAS Name: 3-[[5-[4-[(E)-hydrazinylidenemethyl]phenyl]-1-oxopentyl]amino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-[5-[4-[(E)-hydrazinylidenemethyl]phenyl]pentanoylamino]-3-thiophen-2-ylpropanoic acid Traditional Name: 3-[5-[4-[(E)-hydrazonomethyl]phenyl]pentanoylamino]-3-(2-thienyl)propionic acid Formula: C19H23N3O3S MolecularWeight: 373.46922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(CC(=O)O)NC(=O)CCCCC2=CC=C(C=C2)C=NN

Isomeric SMILES

C1=CSC(=C1)C(CC(=O)O)NC(=O)CCCCC2=CC=C(C=C2)/C=N/N

InChI

InChI=1S/C19H23N3O3S/c20-21-13-15-9-7-14(8-10-15)4-1-2-6-18(23)22-16(12-19(24)25)17-5-3-11-26-17/h3,5,7-11,13,16H,1-2,4,6,12,20H2,(H,22,23)(H,24,25)/b21-13+