N-(4-bromanyl-2-methyl-phenyl)-2-(butylcarbamoylamino)-4-methyl-1,3-thiazole-5-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-(butylcarbamoylamino)-4-methyl-1,3-thiazole-5-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-(butylcarbamoylamino)-4-methyl-thiazole-5-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[butylamino(oxo)methyl]amino]-4-methyl-5-thiazolecarboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-(butylcarbamoylamino)-4-methyl-1,3-thiazole-5-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-(butylcarbamoylamino)-4-methyl-thiazole-5-carboxamide Formula: C17H21BrN4O2S MolecularWeight: 425.34324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=NC(=C(S1)C(=O)NC2=C(C=C(C=C2)Br)C)C

Isomeric SMILES

CCCCNC(=O)NC1=NC(=C(S1)C(=O)NC2=C(C=C(C=C2)Br)C)C

InChI

InChI=1S/C17H21BrN4O2S/c1-4-5-8-19-16(24)22-17-20-11(3)14(25-17)15(23)21-13-7-6-12(18)9-10(13)2/h6-7,9H,4-5,8H2,1-3H3,(H,21,23)(H2,19,20,22,24)