(3-azanylpyrazin-2-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: (3-azanylpyrazin-2-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (3-aminopyrazin-2-yl)-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (3-amino-2-pyrazinyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (3-aminopyrazin-2-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (3-aminopyrazin-2-yl)-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]methanone Formula: C18H23N5O MolecularWeight: 325.40812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=NC=CN=C3N

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=NC=CN=C3N

InChI

InChI=1S/C18H23N5O/c1-14-3-5-15(6-4-14)13-22-9-2-10-23(12-11-22)18(24)16-17(19)21-8-7-20-16/h3-8H,2,9-13H2,1H3,(H2,19,21)