N-[(1S)-2-azanyl-1-(3-chlorophenyl)ethyl]-4-(2-azanylpyrimidin-4-yl)-3,5-dimethyl-1H-pyrrole-2-carboxamide

Systemtic Name: N-[(1S)-2-azanyl-1-(3-chlorophenyl)ethyl]-4-(2-azanylpyrimidin-4-yl)-3,5-dimethyl-1H-pyrrole-2-carboxamide Openeye Name: N-[(1S)-2-amino-1-(3-chlorophenyl)ethyl]-4-(2-aminopyrimidin-4-yl)-3,5-dimethyl-1H-pyrrole-2-carboxamide CAS Name: N-[(1S)-2-amino-1-(3-chlorophenyl)ethyl]-4-(2-amino-4-pyrimidinyl)-3,5-dimethyl-1H-pyrrole-2-carboxamide IUPAC Name: N-[(1S)-2-amino-1-(3-chlorophenyl)ethyl]-4-(2-aminopyrimidin-4-yl)-3,5-dimethyl-1H-pyrrole-2-carboxamide Traditional Name: N-[(1S)-2-amino-1-(3-chlorophenyl)ethyl]-4-(2-aminopyrimidin-4-yl)-3,5-dimethyl-1H-pyrrole-2-carboxamide Formula: C19H21ClN6O MolecularWeight: 384.86264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C2=NC(=NC=C2)N)C)C(=O)NC(CN)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C(NC(=C1C2=NC(=NC=C2)N)C)C(=O)N[C@H](CN)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H21ClN6O/c1-10-16(14-6-7-23-19(22)26-14)11(2)24-17(10)18(27)25-15(9-21)12-4-3-5-13(20)8-12/h3-8,15,24H,9,21H2,1-2H3,(H,25,27)(H2,22,23,26)/t15-/m1/s1