4-[[[2-[(4-bromanyl-3-methyl-phenyl)carbamoyl]thiophen-3-yl]amino]methyl]-N-methyl-pyridine-2-carboxamide

Systemtic Name: 4-[[[2-[(4-bromanyl-3-methyl-phenyl)carbamoyl]thiophen-3-yl]amino]methyl]-N-methyl-pyridine-2-carboxamide Openeye Name: 4-[[[2-[(4-bromo-3-methyl-phenyl)carbamoyl]-3-thienyl]amino]methyl]-N-methyl-pyridine-2-carboxamide CAS Name: 4-[[[2-[(4-bromo-3-methylanilino)-oxomethyl]-3-thiophenyl]amino]methyl]-N-methyl-2-pyridinecarboxamide IUPAC Name: 4-[[[2-[(4-bromo-3-methylphenyl)carbamoyl]thiophen-3-yl]amino]methyl]-N-methylpyridine-2-carboxamide Traditional Name: 4-[[[2-[(4-bromo-3-methyl-phenyl)carbamoyl]-3-thienyl]amino]methyl]-N-methyl-picolinamide Formula: C20H19BrN4O2S MolecularWeight: 459.35946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=C(C=CS2)NCC3=CC(=NC=C3)C(=O)NC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=C(C=CS2)NCC3=CC(=NC=C3)C(=O)NC)Br

InChI

InChI=1S/C20H19BrN4O2S/c1-12-9-14(3-4-15(12)21)25-20(27)18-16(6-8-28-18)24-11-13-5-7-23-17(10-13)19(26)22-2/h3-10,24H,11H2,1-2H3,(H,22,26)(H,25,27)