2-[furan-2-ylmethyl-(phenylmethyl)amino]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone

Systemtic Name: 2-[furan-2-ylmethyl-(phenylmethyl)amino]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Openeye Name: 2-[benzyl(2-furylmethyl)amino]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone CAS Name: 2-[2-furanylmethyl-(phenylmethyl)amino]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone IUPAC Name: 2-[benzyl(furan-2-ylmethyl)amino]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Traditional Name: 2-[benzyl(2-furfuryl)amino]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Formula: C24H26N2O2S MolecularWeight: 406.54044

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)CN(CC3=CC=CC=C3)CC4=CC=CO4

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)CN(CC3=CC=CC=C3)CC4=CC=CO4

InChI

InChI=1S/C24H26N2O2S/c1-19-13-14-26(22-11-5-6-12-23(22)29-19)24(27)18-25(17-21-10-7-15-28-21)16-20-8-3-2-4-9-20/h2-12,15,19H,13-14,16-18H2,1H3