5-[[(6S)-6-methyl-4-oxidanidyl-5,6,7,8-tetrahydroquinazolin-2-yl]sulfanylmethyl]thiophene-2-carboxylate

Systemtic Name: 5-[[(6S)-6-methyl-4-oxidanidyl-5,6,7,8-tetrahydroquinazolin-2-yl]sulfanylmethyl]thiophene-2-carboxylate Openeye Name: 5-[[(6S)-6-methyl-4-oxido-5,6,7,8-tetrahydroquinazolin-2-yl]sulfanylmethyl]thiophene-2-carboxylate CAS Name: 5-[[[(6S)-6-methyl-4-oxido-5,6,7,8-tetrahydroquinazolin-2-yl]thio]methyl]-2-thiophenecarboxylate IUPAC Name: 5-[[(6S)-6-methyl-4-oxido-5,6,7,8-tetrahydroquinazolin-2-yl]sulfanylmethyl]thiophene-2-carboxylate Traditional Name: 5-[[[(6S)-6-methyl-4-oxido-5,6,7,8-tetrahydroquinazolin-2-yl]thio]methyl]-2-thenoate Formula: C15H14N2O3S2-2 MolecularWeight: 334.41326

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=NC(=N2)SCC3=CC=C(S3)C(=O)[O-])[O-]

Isomeric SMILES

C[C@H]1CCC2=C(C1)C(=NC(=N2)SCC3=CC=C(S3)C(=O)[O-])[O-]

InChI

InChI=1S/C15H16N2O3S2/c1-8-2-4-11-10(6-8)13(18)17-15(16-11)21-7-9-3-5-12(22-9)14(19)20/h3,5,8H,2,4,6-7H2,1H3,(H,19,20)(H,16,17,18)/p-2/t8-/m0/s1