3-[2-methoxy-3-(2-methoxyphenyl)sulfanyl-propyl]-3,4-dihydro-2H-1,5-benzoxathiepin-2-amine

Systemtic Name: 3-[2-methoxy-3-(2-methoxyphenyl)sulfanyl-propyl]-3,4-dihydro-2H-1,5-benzoxathiepin-2-amine Openeye Name: 3-[2-methoxy-3-(2-methoxyphenyl)sulfanyl-propyl]-3,4-dihydro-2H-1,5-benzoxathiepin-2-amine CAS Name: 3-[2-methoxy-3-[(2-methoxyphenyl)thio]propyl]-3,4-dihydro-2H-1,5-benzoxathiepin-2-amine IUPAC Name: 3-[2-methoxy-3-(2-methoxyphenyl)sulfanylpropyl]-3,4-dihydro-2H-1,5-benzoxathiepin-2-amine Traditional Name: [3-[2-methoxy-3-[(2-methoxyphenyl)thio]propyl]-3,4-dihydro-2H-1,5-benzoxathiepin-2-yl]amine Formula: C20H25NO3S2 MolecularWeight: 391.5474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1SCC(CC2CSC3=CC=CC=C3OC2N)OC

Isomeric SMILES

COC1=CC=CC=C1SCC(CC2CSC3=CC=CC=C3OC2N)OC

InChI

InChI=1S/C20H25NO3S2/c1-22-15(13-26-18-9-5-3-7-16(18)23-2)11-14-12-25-19-10-6-4-8-17(19)24-20(14)21/h3-10,14-15,20H,11-13,21H2,1-2H3