N-[1-(3-chlorophenyl)-2-oxidanyl-ethyl]-4-[2-(1-oxidanylbutan-2-ylamino)pyrimidin-4-yl]benzamide

Systemtic Name: N-[1-(3-chlorophenyl)-2-oxidanyl-ethyl]-4-[2-(1-oxidanylbutan-2-ylamino)pyrimidin-4-yl]benzamide Openeye Name: N-[1-(3-chlorophenyl)-2-hydroxy-ethyl]-4-[2-[1-(hydroxymethyl)propylamino]pyrimidin-4-yl]benzamide CAS Name: N-[1-(3-chlorophenyl)-2-hydroxyethyl]-4-[2-(1-hydroxybutan-2-ylamino)-4-pyrimidinyl]benzamide IUPAC Name: N-[1-(3-chlorophenyl)-2-hydroxyethyl]-4-[2-(1-hydroxybutan-2-ylamino)pyrimidin-4-yl]benzamide Traditional Name: N-[1-(3-chlorophenyl)-2-hydroxy-ethyl]-4-[2-(1-methylolpropylamino)pyrimidin-4-yl]benzamide Formula: C23H25ClN4O3 MolecularWeight: 440.9226

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=NC=CC(=N1)C2=CC=C(C=C2)C(=O)NC(CO)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCC(CO)NC1=NC=CC(=N1)C2=CC=C(C=C2)C(=O)NC(CO)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H25ClN4O3/c1-2-19(13-29)26-23-25-11-10-20(28-23)15-6-8-16(9-7-15)22(31)27-21(14-30)17-4-3-5-18(24)12-17/h3-12,19,21,29-30H,2,13-14H2,1H3,(H,27,31)(H,25,26,28)