4,7-dimethyl-3-[3-oxidanylidene-3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propyl]chromen-2-one

Systemtic Name: 4,7-dimethyl-3-[3-oxidanylidene-3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propyl]chromen-2-one Openeye Name: 4,7-dimethyl-3-[3-oxo-3-(4-thiazol-2-ylpiperazin-1-yl)propyl]chromen-2-one CAS Name: 4,7-dimethyl-3-[3-oxo-3-[4-(2-thiazolyl)-1-piperazinyl]propyl]-1-benzopyran-2-one IUPAC Name: 4,7-dimethyl-3-[3-oxo-3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propyl]chromen-2-one Traditional Name: 3-[3-keto-3-(4-thiazol-2-ylpiperazino)propyl]-4,7-dimethyl-coumarin Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)N3CCN(CC3)C4=NC=CS4)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)N3CCN(CC3)C4=NC=CS4)C

InChI

InChI=1S/C21H23N3O3S/c1-14-3-4-16-15(2)17(20(26)27-18(16)13-14)5-6-19(25)23-8-10-24(11-9-23)21-22-7-12-28-21/h3-4,7,12-13H,5-6,8-11H2,1-2H3