4-[1-azanyl-2-[(2-methyl-2-thiophen-3-yl-propanoyl)amino]ethyl]-N-pyridin-4-yl-benzamide

Systemtic Name: 4-[1-azanyl-2-[(2-methyl-2-thiophen-3-yl-propanoyl)amino]ethyl]-N-pyridin-4-yl-benzamide Openeye Name: 4-[1-amino-2-[[2-methyl-2-(3-thienyl)propanoyl]amino]ethyl]-N-(4-pyridyl)benzamide CAS Name: 4-[1-amino-2-[[2-methyl-1-oxo-2-(3-thiophenyl)propyl]amino]ethyl]-N-pyridin-4-ylbenzamide IUPAC Name: 4-[1-amino-2-[(2-methyl-2-thiophen-3-ylpropanoyl)amino]ethyl]-N-pyridin-4-ylbenzamide Traditional Name: 4-[1-amino-2-[[2-methyl-2-(3-thienyl)propanoyl]amino]ethyl]-N-(4-pyridyl)benzamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CSC=C1)C(=O)NCC(C2=CC=C(C=C2)C(=O)NC3=CC=NC=C3)N

Isomeric SMILES

CC(C)(C1=CSC=C1)C(=O)NCC(C2=CC=C(C=C2)C(=O)NC3=CC=NC=C3)N

InChI

InChI=1S/C22H24N4O2S/c1-22(2,17-9-12-29-14-17)21(28)25-13-19(23)15-3-5-16(6-4-15)20(27)26-18-7-10-24-11-8-18/h3-12,14,19H,13,23H2,1-2H3,(H,25,28)(H,24,26,27)