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

Systemtic Name: 4-(2-acetamidoethanoylamino)-N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[(2-acetamidoacetyl)amino]-N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[(2-acetamido-1-oxoethyl)amino]-N-[5-[[3-(dimethylamino)propylamino]-oxomethyl]-1-methyl-3-pyrrolyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[(2-acetamidoacetyl)amino]-N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methylpyrrol-3-yl]-1-methylpyrrole-2-carboxamide Traditional Name: 4-[(2-acetamidoacetyl)amino]-N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]-1-methyl-pyrrole-2-carboxamide Formula: C21H31N7O4 MolecularWeight: 445.51534

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC(=O)NC1=CN(C(=C1)C(=O)NC2=CN(C(=C2)C(=O)NCCCN(C)C)C)C

Isomeric SMILES

CC(=O)NCC(=O)NC1=CN(C(=C1)C(=O)NC2=CN(C(=C2)C(=O)NCCCN(C)C)C)C

InChI

InChI=1S/C21H31N7O4/c1-14(29)23-11-19(30)24-15-9-18(28(5)12-15)21(32)25-16-10-17(27(4)13-16)20(31)22-7-6-8-26(2)3/h9-10,12-13H,6-8,11H2,1-5H3,(H,22,31)(H,23,29)(H,24,30)(H,25,32)