N-[3-[(2-azanylpyrimidin-5-yl)carbamoyl]-4-methyl-phenyl]-1H-indole-5-carboxamide

Systemtic Name: N-[3-[(2-azanylpyrimidin-5-yl)carbamoyl]-4-methyl-phenyl]-1H-indole-5-carboxamide Openeye Name: N-[3-[(2-aminopyrimidin-5-yl)carbamoyl]-4-methyl-phenyl]-1H-indole-5-carboxamide CAS Name: N-[3-[[(2-amino-5-pyrimidinyl)amino]-oxomethyl]-4-methylphenyl]-1H-indole-5-carboxamide IUPAC Name: N-[3-[(2-aminopyrimidin-5-yl)carbamoyl]-4-methylphenyl]-1H-indole-5-carboxamide Traditional Name: N-[3-[(2-aminopyrimidin-5-yl)carbamoyl]-4-methyl-phenyl]-1H-indole-5-carboxamide Formula: C21H18N6O2 MolecularWeight: 386.40662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)NC=C3)C(=O)NC4=CN=C(N=C4)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)NC=C3)C(=O)NC4=CN=C(N=C4)N

InChI

InChI=1S/C21H18N6O2/c1-12-2-4-15(9-17(12)20(29)27-16-10-24-21(22)25-11-16)26-19(28)14-3-5-18-13(8-14)6-7-23-18/h2-11,23H,1H3,(H,26,28)(H,27,29)(H2,22,24,25)