(3S)-3-(4-thiophen-2-ylcarbonylpiperazin-1-yl)carbonyl-3,4-dihydroisochromen-1-one

Systemtic Name: (3S)-3-(4-thiophen-2-ylcarbonylpiperazin-1-yl)carbonyl-3,4-dihydroisochromen-1-one Openeye Name: (3S)-3-[4-(thiophene-2-carbonyl)piperazine-1-carbonyl]isochroman-1-one CAS Name: (3S)-3-[oxo-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]methyl]-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: (3S)-3-[4-(thiophene-2-carbonyl)piperazine-1-carbonyl]-3,4-dihydroisochromen-1-one Traditional Name: (3S)-3-[4-(2-thenoyl)piperazine-1-carbonyl]isochroman-1-one Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2CC3=CC=CC=C3C(=O)O2)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)[C@@H]2CC3=CC=CC=C3C(=O)O2)C(=O)C4=CC=CS4

InChI

InChI=1S/C19H18N2O4S/c22-17(15-12-13-4-1-2-5-14(13)19(24)25-15)20-7-9-21(10-8-20)18(23)16-6-3-11-26-16/h1-6,11,15H,7-10,12H2/t15-/m0/s1