5-(4-methoxyphenyl)-2-methyl-5,11-dihydropyrano[3,4-c][1,5]benzothiazepin-4-one

Systemtic Name: 5-(4-methoxyphenyl)-2-methyl-5,11-dihydropyrano[3,4-c][1,5]benzothiazepin-4-one Openeye Name: 5-(4-methoxyphenyl)-2-methyl-5,11-dihydropyrano[3,4-c][1,5]benzothiazepin-4-one CAS Name: 5-(4-methoxyphenyl)-2-methyl-5,11-dihydropyrano[3,4-c][1,5]benzothiazepin-4-one IUPAC Name: 5-(4-methoxyphenyl)-2-methyl-5,11-dihydropyrano[3,4-c][1,5]benzothiazepin-4-one Traditional Name: 5-(4-methoxyphenyl)-2-methyl-5,11-dihydropyrano[3,4-c][1,5]benzothiazepin-4-one Formula: C20H17NO3S MolecularWeight: 351.41888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(SC3=CC=CC=C3N2)C4=CC=C(C=C4)OC)C(=O)O1

Isomeric SMILES

CC1=CC2=C(C(SC3=CC=CC=C3N2)C4=CC=C(C=C4)OC)C(=O)O1

InChI

InChI=1S/C20H17NO3S/c1-12-11-16-18(20(22)24-12)19(13-7-9-14(23-2)10-8-13)25-17-6-4-3-5-15(17)21-16/h3-11,19,21H,1-2H3