N-(2-acetamidoethyl)-4-bromanyl-3-[(2-chlorophenyl)carbonylamino]-1H-pyrazole-5-carboxamide

Systemtic Name: N-(2-acetamidoethyl)-4-bromanyl-3-[(2-chlorophenyl)carbonylamino]-1H-pyrazole-5-carboxamide Openeye Name: N-(2-acetamidoethyl)-4-bromo-3-[(2-chlorobenzoyl)amino]-1H-pyrazole-5-carboxamide CAS Name: N-(2-acetamidoethyl)-4-bromo-3-[[(2-chlorophenyl)-oxomethyl]amino]-1H-pyrazole-5-carboxamide IUPAC Name: N-(2-acetamidoethyl)-4-bromo-3-[(2-chlorobenzoyl)amino]-1H-pyrazole-5-carboxamide Traditional Name: N-(2-acetamidoethyl)-4-bromo-3-[(2-chlorobenzoyl)amino]-1H-pyrazole-5-carboxamide Formula: C15H15BrClN5O3 MolecularWeight: 428.6683

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C1=C(C(=NN1)NC(=O)C2=CC=CC=C2Cl)Br

Isomeric SMILES

CC(=O)NCCNC(=O)C1=C(C(=NN1)NC(=O)C2=CC=CC=C2Cl)Br

InChI

InChI=1S/C15H15BrClN5O3/c1-8(23)18-6-7-19-15(25)12-11(16)13(22-21-12)20-14(24)9-4-2-3-5-10(9)17/h2-5H,6-7H2,1H3,(H,18,23)(H,19,25)(H2,20,21,22,24)