1-[(4-methoxyphenyl)methyl]-6-(pyridin-3-ylmethoxy)-4-(thiophen-3-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-6-(pyridin-3-ylmethoxy)-4-(thiophen-3-ylmethyl)-1,4-diazepan-2-one Openeye Name: 1-[(4-methoxyphenyl)methyl]-6-(3-pyridylmethoxy)-4-(3-thienylmethyl)-1,4-diazepan-2-one CAS Name: 1-[(4-methoxyphenyl)methyl]-6-(3-pyridinylmethoxy)-4-(3-thiophenylmethyl)-1,4-diazepan-2-one IUPAC Name: 1-[(4-methoxyphenyl)methyl]-6-(pyridin-3-ylmethoxy)-4-(thiophen-3-ylmethyl)-1,4-diazepan-2-one Traditional Name: 1-p-anisyl-6-(3-pyridylmethoxy)-4-(3-thenyl)-1,4-diazepan-2-one Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CC(CN(CC2=O)CC3=CSC=C3)OCC4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CN2CC(CN(CC2=O)CC3=CSC=C3)OCC4=CN=CC=C4

InChI

InChI=1S/C24H27N3O3S/c1-29-22-6-4-19(5-7-22)13-27-15-23(30-17-20-3-2-9-25-11-20)14-26(16-24(27)28)12-21-8-10-31-18-21/h2-11,18,23H,12-17H2,1H3