5-[(E)-3-(furan-2-yl)prop-2-enyl]-2-(2-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: 5-[(E)-3-(furan-2-yl)prop-2-enyl]-2-(2-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one Openeye Name: 5-[(E)-3-(2-furyl)allyl]-2-(2-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one CAS Name: 5-[(E)-3-(2-furanyl)prop-2-enyl]-2-(2-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one IUPAC Name: 5-[(E)-3-(furan-2-yl)prop-2-enyl]-2-(2-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one Traditional Name: 5-[(E)-3-(2-furyl)allyl]-2-(2-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one Formula: C23H21NO3S MolecularWeight: 391.48274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2CC(=O)N(C3=CC=CC=C3S2)CC=CC4=CC=CO4

Isomeric SMILES

COC1=CC=CC=C1C2CC(=O)N(C3=CC=CC=C3S2)C/C=C/C4=CC=CO4

InChI

InChI=1S/C23H21NO3S/c1-26-20-12-4-2-10-18(20)22-16-23(25)24(14-6-8-17-9-7-15-27-17)19-11-3-5-13-21(19)28-22/h2-13,15,22H,14,16H2,1H3/b8-6+