[(3S)-6-chloranyl-3,4-dihydro-2H-chromen-3-yl]-(4-thiophen-2-ylcarbonylpiperazin-1-yl)methanone

Systemtic Name: [(3S)-6-chloranyl-3,4-dihydro-2H-chromen-3-yl]-(4-thiophen-2-ylcarbonylpiperazin-1-yl)methanone Openeye Name: [(3S)-6-chlorochroman-3-yl]-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone CAS Name: [(3S)-6-chloro-3,4-dihydro-2H-1-benzopyran-3-yl]-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]methanone IUPAC Name: [(3S)-6-chloro-3,4-dihydro-2H-chromen-3-yl]-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone Traditional Name: [(3S)-6-chlorochroman-3-yl]-[4-(2-thenoyl)piperazino]methanone Formula: C19H19ClN2O3S MolecularWeight: 390.88376

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2CC3=C(C=CC(=C3)Cl)OC2)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)[C@H]2CC3=C(C=CC(=C3)Cl)OC2)C(=O)C4=CC=CS4

InChI

InChI=1S/C19H19ClN2O3S/c20-15-3-4-16-13(11-15)10-14(12-25-16)18(23)21-5-7-22(8-6-21)19(24)17-2-1-9-26-17/h1-4,9,11,14H,5-8,10,12H2/t14-/m0/s1