(1,5-dimethyl-2-phenyl-indol-3-yl)-[4-(5-propylpyrimidin-2-yl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (1,5-dimethyl-2-phenyl-indol-3-yl)-[4-(5-propylpyrimidin-2-yl)-1,4-diazepan-1-yl]methanone Openeye Name: (1,5-dimethyl-2-phenyl-indol-3-yl)-[4-(5-propylpyrimidin-2-yl)-1,4-diazepan-1-yl]methanone CAS Name: (1,5-dimethyl-2-phenyl-3-indolyl)-[4-(5-propyl-2-pyrimidinyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (1,5-dimethyl-2-phenylindol-3-yl)-[4-(5-propylpyrimidin-2-yl)-1,4-diazepan-1-yl]methanone Traditional Name: (1,5-dimethyl-2-phenyl-indol-3-yl)-[4-(5-propylpyrimidin-2-yl)-1,4-diazepan-1-yl]methanone Formula: C29H33N5O MolecularWeight: 467.60522

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CN=C(N=C1)N2CCCN(CC2)C(=O)C3=C(N(C4=C3C=C(C=C4)C)C)C5=CC=CC=C5

Isomeric SMILES

CCCC1=CN=C(N=C1)N2CCCN(CC2)C(=O)C3=C(N(C4=C3C=C(C=C4)C)C)C5=CC=CC=C5

InChI

InChI=1S/C29H33N5O/c1-4-9-22-19-30-29(31-20-22)34-15-8-14-33(16-17-34)28(35)26-24-18-21(2)12-13-25(24)32(3)27(26)23-10-6-5-7-11-23/h5-7,10-13,18-20H,4,8-9,14-17H2,1-3H3