4-[(5-bromanylthiophen-2-yl)carbonylamino]-N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-[(5-bromanylthiophen-2-yl)carbonylamino]-N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[(5-bromothiophene-2-carbonyl)amino]-N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[(5-bromo-2-thiophenyl)-oxomethyl]amino]-N-[5-[[3-(dimethylamino)propylamino]-oxomethyl]-1-methyl-3-pyrrolyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[(5-bromothiophene-2-carbonyl)amino]-N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide Traditional Name: 4-[(5-bromothiophene-2-carbonyl)amino]-N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-pyrrole-2-carboxamide Formula: C22H27BrN6O3S MolecularWeight: 535.45718

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NCCCN(C)C)C)NC(=O)C3=CC=C(S3)Br

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NCCCN(C)C)C)NC(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C22H27BrN6O3S/c1-27(2)9-5-8-24-20(30)16-10-14(12-28(16)3)25-21(31)17-11-15(13-29(17)4)26-22(32)18-6-7-19(23)33-18/h6-7,10-13H,5,8-9H2,1-4H3,(H,24,30)(H,25,31)(H,26,32)