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

Systemtic Name: 1-(3-methoxyphenyl)-3-[(3R)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]urea Openeye Name: 1-(3-methoxyphenyl)-3-[(3R)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]urea CAS Name: 1-(3-methoxyphenyl)-3-[(3R)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]urea IUPAC Name: 1-(3-methoxyphenyl)-3-[(3R)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]urea Traditional Name: 1-[(3R)-4-keto-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]-3-(3-methoxyphenyl)urea Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)NC2CSC3=CC=CC=C3NC2=O

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)N[C@H]2CSC3=CC=CC=C3NC2=O

InChI

InChI=1S/C17H17N3O3S/c1-23-12-6-4-5-11(9-12)18-17(22)20-14-10-24-15-8-3-2-7-13(15)19-16(14)21/h2-9,14H,10H2,1H3,(H,19,21)(H2,18,20,22)/t14-/m0/s1