6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-(1,3-thiazol-4-ylcarbonyl)-1,4-diazepan-2-one

Systemtic Name: 6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-(1,3-thiazol-4-ylcarbonyl)-1,4-diazepan-2-one Openeye Name: 6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-(thiazole-4-carbonyl)-1,4-diazepan-2-one CAS Name: 6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-[oxo(4-thiazolyl)methyl]-1,4-diazepan-2-one IUPAC Name: 6-(cyclopropylmethoxy)-1-[(3-methoxyphenyl)methyl]-4-(1,3-thiazole-4-carbonyl)-1,4-diazepan-2-one Traditional Name: 6-(cyclopropylmethoxy)-1-m-anisyl-4-(thiazole-4-carbonyl)-1,4-diazepan-2-one Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CC(CN(CC2=O)C(=O)C3=CSC=N3)OCC4CC4

Isomeric SMILES

COC1=CC=CC(=C1)CN2CC(CN(CC2=O)C(=O)C3=CSC=N3)OCC4CC4

InChI

InChI=1S/C21H25N3O4S/c1-27-17-4-2-3-16(7-17)8-23-9-18(28-12-15-5-6-15)10-24(11-20(23)25)21(26)19-13-29-14-22-19/h2-4,7,13-15,18H,5-6,8-12H2,1H3