3-[3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]-4,8-dimethyl-7-oxidanyl-chromen-2-one

Systemtic Name: 3-[3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]-4,8-dimethyl-7-oxidanyl-chromen-2-one Openeye Name: 3-[3-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-3-oxo-propyl]-7-hydroxy-4,8-dimethyl-chromen-2-one CAS Name: 3-[3-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-oxopropyl]-7-hydroxy-4,8-dimethyl-1-benzopyran-2-one IUPAC Name: 3-[3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxopropyl]-7-hydroxy-4,8-dimethylchromen-2-one Traditional Name: 3-[3-[4-(1,3-benzothiazol-2-yl)piperidino]-3-keto-propyl]-7-hydroxy-4,8-dimethyl-coumarin Formula: C26H26N2O4S MolecularWeight: 462.56064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CCC(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CCC(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H26N2O4S/c1-15-18-7-9-21(29)16(2)24(18)32-26(31)19(15)8-10-23(30)28-13-11-17(12-14-28)25-27-20-5-3-4-6-22(20)33-25/h3-7,9,17,29H,8,10-14H2,1-2H3