4-[(3-methoxyphenyl)methyl]-N-(4-methyl-2-oxidanylidene-chromen-7-yl)piperazine-1-carbothioamide

Systemtic Name: 4-[(3-methoxyphenyl)methyl]-N-(4-methyl-2-oxidanylidene-chromen-7-yl)piperazine-1-carbothioamide Openeye Name: 4-[(3-methoxyphenyl)methyl]-N-(4-methyl-2-oxo-chromen-7-yl)piperazine-1-carbothioamide CAS Name: 4-[(3-methoxyphenyl)methyl]-N-(4-methyl-2-oxo-1-benzopyran-7-yl)-1-piperazinecarbothioamide IUPAC Name: 4-[(3-methoxyphenyl)methyl]-N-(4-methyl-2-oxochromen-7-yl)piperazine-1-carbothioamide Traditional Name: N-(2-keto-4-methyl-chromen-7-yl)-4-m-anisyl-piperazine-1-carbothioamide Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)N3CCN(CC3)CC4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)N3CCN(CC3)CC4=CC(=CC=C4)OC

InChI

InChI=1S/C23H25N3O3S/c1-16-12-22(27)29-21-14-18(6-7-20(16)21)24-23(30)26-10-8-25(9-11-26)15-17-4-3-5-19(13-17)28-2/h3-7,12-14H,8-11,15H2,1-2H3,(H,24,30)