N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]-2H-benzotriazole-5-carboxamide

Systemtic Name: N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]-2H-benzotriazole-5-carboxamide Openeye Name: N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]-2H-benzotriazole-5-carboxamide CAS Name: N-[5-[[3-(dimethylamino)propylamino]-oxomethyl]-1-methyl-3-pyrrolyl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methylpyrrol-3-yl]-2H-benzotriazole-5-carboxamide Traditional Name: N-[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]-2H-benzotriazole-5-carboxamide Formula: C18H23N7O2 MolecularWeight: 369.42092

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCCCN(C)C)NC(=O)C2=CC3=NNN=C3C=C2

Isomeric SMILES

CN1C=C(C=C1C(=O)NCCCN(C)C)NC(=O)C2=CC3=NNN=C3C=C2

InChI

InChI=1S/C18H23N7O2/c1-24(2)8-4-7-19-18(27)16-10-13(11-25(16)3)20-17(26)12-5-6-14-15(9-12)22-23-21-14/h5-6,9-11H,4,7-8H2,1-3H3,(H,19,27)(H,20,26)(H,21,22,23)