6-[(3-methoxyphenyl)methoxy]-1-(2-methylpropyl)-4-(thiolan-3-yl)-1,4-diazepan-2-one

Systemtic Name: 6-[(3-methoxyphenyl)methoxy]-1-(2-methylpropyl)-4-(thiolan-3-yl)-1,4-diazepan-2-one Openeye Name: 1-isobutyl-6-[(3-methoxyphenyl)methoxy]-4-tetrahydrothiophen-3-yl-1,4-diazepan-2-one CAS Name: 6-[(3-methoxyphenyl)methoxy]-1-(2-methylpropyl)-4-(3-thiolanyl)-1,4-diazepan-2-one IUPAC Name: 6-[(3-methoxyphenyl)methoxy]-1-(2-methylpropyl)-4-(thiolan-3-yl)-1,4-diazepan-2-one Traditional Name: 1-isobutyl-6-m-anisyloxy-4-tetrahydrothiophen-3-yl-1,4-diazepan-2-one Formula: C21H32N2O3S MolecularWeight: 392.55538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CN(CC1=O)C2CCSC2)OCC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)CN1CC(CN(CC1=O)C2CCSC2)OCC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H32N2O3S/c1-16(2)10-23-12-20(26-14-17-5-4-6-19(9-17)25-3)11-22(13-21(23)24)18-7-8-27-15-18/h4-6,9,16,18,20H,7-8,10-15H2,1-3H3