2-[(3-bromanyl-4-methyl-phenyl)carbonylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide

Systemtic Name: 2-[(3-bromanyl-4-methyl-phenyl)carbonylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide Openeye Name: 5-benzyl-2-[(3-bromo-4-methyl-benzoyl)amino]-4-methyl-thiophene-3-carboxamide CAS Name: 2-[[(3-bromo-4-methylphenyl)-oxomethyl]amino]-4-methyl-5-(phenylmethyl)-3-thiophenecarboxamide IUPAC Name: 5-benzyl-2-[(3-bromo-4-methylbenzoyl)amino]-4-methylthiophene-3-carboxamide Traditional Name: 5-benzyl-2-[(3-bromo-4-methyl-benzoyl)amino]-4-methyl-thiophene-3-carboxamide Formula: C21H19BrN2O2S MolecularWeight: 443.35676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C(=C(S2)CC3=CC=CC=C3)C)C(=O)N)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C(=C(S2)CC3=CC=CC=C3)C)C(=O)N)Br

InChI

InChI=1S/C21H19BrN2O2S/c1-12-8-9-15(11-16(12)22)20(26)24-21-18(19(23)25)13(2)17(27-21)10-14-6-4-3-5-7-14/h3-9,11H,10H2,1-2H3,(H2,23,25)(H,24,26)