N-[(2R)-2-[4-(1H-indol-4-yl)piperazin-1-yl]propyl]-N-pyridin-2-yl-adamantane-1-carboxamide

Systemtic Name: N-[(2R)-2-[4-(1H-indol-4-yl)piperazin-1-yl]propyl]-N-pyridin-2-yl-adamantane-1-carboxamide Openeye Name: N-[(2R)-2-[4-(1H-indol-4-yl)piperazin-1-yl]propyl]-N-(2-pyridyl)adamantane-1-carboxamide CAS Name: N-[(2R)-2-[4-(1H-indol-4-yl)-1-piperazinyl]propyl]-N-(2-pyridinyl)-1-adamantanecarboxamide IUPAC Name: N-[(2R)-2-[4-(1H-indol-4-yl)piperazin-1-yl]propyl]-N-pyridin-2-yladamantane-1-carboxamide Traditional Name: N-[(2R)-2-[4-(1H-indol-4-yl)piperazino]propyl]-N-(2-pyridyl)adamantane-1-carboxamide Formula: C31H39N5O MolecularWeight: 497.67426

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C1=CC=CC=N1)C(=O)C23CC4CC(C2)CC(C4)C3)N5CCN(CC5)C6=CC=CC7=C6C=CN7

Isomeric SMILES

C[C@H](CN(C1=CC=CC=N1)C(=O)C23CC4CC(C2)CC(C4)C3)N5CCN(CC5)C6=CC=CC7=C6C=CN7

InChI

InChI=1S/C31H39N5O/c1-22(34-11-13-35(14-12-34)28-6-4-5-27-26(28)8-10-32-27)21-36(29-7-2-3-9-33-29)30(37)31-18-23-15-24(19-31)17-25(16-23)20-31/h2-10,22-25,32H,11-21H2,1H3/t22-,23?,24?,25?,31?/m1/s1