1-[4-(furan-2-yl)-2,3-dihydro-1,5-benzothiazepin-2-yl]pentane-2,3-dione

Systemtic Name: 1-[4-(furan-2-yl)-2,3-dihydro-1,5-benzothiazepin-2-yl]pentane-2,3-dione Openeye Name: 1-[4-(2-furyl)-2,3-dihydro-1,5-benzothiazepin-2-yl]pentane-2,3-dione CAS Name: 1-[4-(2-furanyl)-2,3-dihydro-1,5-benzothiazepin-2-yl]pentane-2,3-dione IUPAC Name: 1-[4-(furan-2-yl)-2,3-dihydro-1,5-benzothiazepin-2-yl]pentane-2,3-dione Traditional Name: 1-[4-(2-furyl)-2,3-dihydro-1,5-benzothiazepin-2-yl]pentane-2,3-dione Formula: C18H17NO3S MolecularWeight: 327.39748

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(=O)CC1CC(=NC2=CC=CC=C2S1)C3=CC=CO3

Isomeric SMILES

CCC(=O)C(=O)CC1CC(=NC2=CC=CC=C2S1)C3=CC=CO3

InChI

InChI=1S/C18H17NO3S/c1-2-15(20)16(21)11-12-10-14(17-7-5-9-22-17)19-13-6-3-4-8-18(13)23-12/h3-9,12H,2,10-11H2,1H3