1-(3-methoxyphenyl)-3-[5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-3-yl]urea

Systemtic Name: 1-(3-methoxyphenyl)-3-[5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-3-yl]urea Openeye Name: 1-(3-methoxyphenyl)-3-[5-(2-morpholino-2-oxo-ethyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl]urea CAS Name: 1-(3-methoxyphenyl)-3-[5-[2-(4-morpholinyl)-2-oxoethyl]-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl]urea IUPAC Name: 1-(3-methoxyphenyl)-3-[5-(2-morpholin-4-yl-2-oxoethyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl]urea Traditional Name: 1-[4-keto-5-(2-keto-2-morpholino-ethyl)-2,3-dihydro-1,5-benzothiazepin-3-yl]-3-(3-methoxyphenyl)urea Formula: C23H26N4O5S MolecularWeight: 470.54134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)NC2CSC3=CC=CC=C3N(C2=O)CC(=O)N4CCOCC4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)NC2CSC3=CC=CC=C3N(C2=O)CC(=O)N4CCOCC4

InChI

InChI=1S/C23H26N4O5S/c1-31-17-6-4-5-16(13-17)24-23(30)25-18-15-33-20-8-3-2-7-19(20)27(22(18)29)14-21(28)26-9-11-32-12-10-26/h2-8,13,18H,9-12,14-15H2,1H3,(H2,24,25,30)