N-[3-[2-[1H-inden-2-yl(propyl)amino]ethyl]phenyl]-4-pyrimidin-2-yl-benzamide

Systemtic Name: N-[3-[2-[1H-inden-2-yl(propyl)amino]ethyl]phenyl]-4-pyrimidin-2-yl-benzamide Openeye Name: N-[3-[2-[1H-inden-2-yl(propyl)amino]ethyl]phenyl]-4-pyrimidin-2-yl-benzamide CAS Name: N-[3-[2-[1H-inden-2-yl(propyl)amino]ethyl]phenyl]-4-(2-pyrimidinyl)benzamide IUPAC Name: N-[3-[2-[1H-inden-2-yl(propyl)amino]ethyl]phenyl]-4-pyrimidin-2-ylbenzamide Traditional Name: N-[3-[2-[1H-inden-2-yl(propyl)amino]ethyl]phenyl]-4-(2-pyrimidyl)benzamide Formula: C31H30N4O MolecularWeight: 474.5961

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)C3=NC=CC=N3)C4=CC5=CC=CC=C5C4

Isomeric SMILES

CCCN(CCC1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)C3=NC=CC=N3)C4=CC5=CC=CC=C5C4

InChI

InChI=1S/C31H30N4O/c1-2-18-35(29-21-26-8-3-4-9-27(26)22-29)19-15-23-7-5-10-28(20-23)34-31(36)25-13-11-24(12-14-25)30-32-16-6-17-33-30/h3-14,16-17,20-21H,2,15,18-19,22H2,1H3,(H,34,36)