4-[3-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]-1,4-benzothiazin-3-one

Systemtic Name: 4-[3-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]-1,4-benzothiazin-3-one Openeye Name: 4-[3-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-oxo-propyl]-1,4-benzothiazin-3-one CAS Name: 4-[3-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]-1,4-benzothiazin-3-one IUPAC Name: 4-[3-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]-1,4-benzothiazin-3-one Traditional Name: 4-[3-keto-3-(4-p-anisyl-1,4-diazepan-1-yl)propyl]-1,4-benzothiazin-3-one Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)CCN3C(=O)CSC4=CC=CC=C43

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)CCN3C(=O)CSC4=CC=CC=C43

InChI

InChI=1S/C24H29N3O3S/c1-30-20-9-7-19(8-10-20)17-25-12-4-13-26(16-15-25)23(28)11-14-27-21-5-2-3-6-22(21)31-18-24(27)29/h2-3,5-10H,4,11-18H2,1H3