3-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylchromen-4-one

Systemtic Name: 3-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylchromen-4-one Openeye Name: 3-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]chromen-4-one CAS Name: 3-[[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-oxomethyl]-1-benzopyran-4-one IUPAC Name: 3-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]chromen-4-one Traditional Name: 3-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]chromone Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)N3CCN(CC3)C(=O)C4=COC5=CC=CC=C5C4=O)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)N3CCN(CC3)C(=O)C4=COC5=CC=CC=C5C4=O)C

InChI

InChI=1S/C23H21N3O3S/c1-14-7-8-19-20(15(14)2)24-23(30-19)26-11-9-25(10-12-26)22(28)17-13-29-18-6-4-3-5-16(18)21(17)27/h3-8,13H,9-12H2,1-2H3