6-methyl-3-[(7S)-7-thiophen-3-yl-1,4-thiazepan-5-ylidene]pyran-2,4-dione

Systemtic Name: 6-methyl-3-[(7S)-7-thiophen-3-yl-1,4-thiazepan-5-ylidene]pyran-2,4-dione Openeye Name: 6-methyl-3-[(7S)-7-(3-thienyl)-1,4-thiazepan-5-ylidene]pyran-2,4-dione CAS Name: 6-methyl-3-[(7S)-7-(3-thiophenyl)-1,4-thiazepan-5-ylidene]pyran-2,4-dione IUPAC Name: 6-methyl-3-[(7S)-7-thiophen-3-yl-1,4-thiazepan-5-ylidene]pyran-2,4-dione Traditional Name: 6-methyl-3-[(7S)-7-(3-thienyl)-1,4-thiazepan-5-ylidene]pyran-2,4-quinone Formula: C15H15NO3S2 MolecularWeight: 321.4145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C2CC(SCCN2)C3=CSC=C3)C(=O)O1

Isomeric SMILES

CC1=CC(=O)C(=C2C[C@H](SCCN2)C3=CSC=C3)C(=O)O1

InChI

InChI=1S/C15H15NO3S2/c1-9-6-12(17)14(15(18)19-9)11-7-13(21-5-3-16-11)10-2-4-20-8-10/h2,4,6,8,13,16H,3,5,7H2,1H3/t13-/m0/s1