[2-(4-methoxyphenyl)-4-oxidanylidene-5-(2-piperidin-1-ylethyl)-2,3-dihydro-1,5-benzothiazepin-3-yl] N-methylcarbamate

Systemtic Name: [2-(4-methoxyphenyl)-4-oxidanylidene-5-(2-piperidin-1-ylethyl)-2,3-dihydro-1,5-benzothiazepin-3-yl] N-methylcarbamate Openeye Name: [2-(4-methoxyphenyl)-4-oxo-5-[2-(1-piperidyl)ethyl]-2,3-dihydro-1,5-benzothiazepin-3-yl] N-methylcarbamate CAS Name: N-methylcarbamic acid [2-(4-methoxyphenyl)-4-oxo-5-[2-(1-piperidinyl)ethyl]-2,3-dihydro-1,5-benzothiazepin-3-yl] ester IUPAC Name: [2-(4-methoxyphenyl)-4-oxo-5-(2-piperidin-1-ylethyl)-2,3-dihydro-1,5-benzothiazepin-3-yl] N-methylcarbamate Traditional Name: N-methylcarbamic acid [4-keto-2-(4-methoxyphenyl)-5-(2-piperidinoethyl)-2,3-dihydro-1,5-benzothiazepin-3-yl] ester Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)OC1C(SC2=CC=CC=C2N(C1=O)CCN3CCCCC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CNC(=O)OC1C(SC2=CC=CC=C2N(C1=O)CCN3CCCCC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H31N3O4S/c1-26-25(30)32-22-23(18-10-12-19(31-2)13-11-18)33-21-9-5-4-8-20(21)28(24(22)29)17-16-27-14-6-3-7-15-27/h4-5,8-13,22-23H,3,6-7,14-17H2,1-2H3,(H,26,30)