6-(cyclopropylmethoxy)-4-[(1,3-dimethylpyrazol-4-yl)methyl]-1-(phenylmethyl)-1,4-diazepan-2-one

Systemtic Name: 6-(cyclopropylmethoxy)-4-[(1,3-dimethylpyrazol-4-yl)methyl]-1-(phenylmethyl)-1,4-diazepan-2-one Openeye Name: 1-benzyl-6-(cyclopropylmethoxy)-4-[(1,3-dimethylpyrazol-4-yl)methyl]-1,4-diazepan-2-one CAS Name: 6-(cyclopropylmethoxy)-4-[(1,3-dimethyl-4-pyrazolyl)methyl]-1-(phenylmethyl)-1,4-diazepan-2-one IUPAC Name: 1-benzyl-6-(cyclopropylmethoxy)-4-[(1,3-dimethylpyrazol-4-yl)methyl]-1,4-diazepan-2-one Traditional Name: 1-benzyl-6-(cyclopropylmethoxy)-4-[(1,3-dimethylpyrazol-4-yl)methyl]-1,4-diazepan-2-one Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CN2CC(CN(C(=O)C2)CC3=CC=CC=C3)OCC4CC4)C

Isomeric SMILES

CC1=NN(C=C1CN2CC(CN(C(=O)C2)CC3=CC=CC=C3)OCC4CC4)C

InChI

InChI=1S/C22H30N4O2/c1-17-20(11-24(2)23-17)12-25-13-21(28-16-19-8-9-19)14-26(22(27)15-25)10-18-6-4-3-5-7-18/h3-7,11,19,21H,8-10,12-16H2,1-2H3