methyl (5Z)-5-[(3S,4R)-3-acetamido-4-benzamido-thiolan-2-ylidene]pentanoate

Systemtic Name: methyl (5Z)-5-[(3S,4R)-3-acetamido-4-benzamido-thiolan-2-ylidene]pentanoate Openeye Name: methyl (5Z)-5-[(3S,4R)-3-acetamido-4-benzamido-tetrahydrothiophen-2-ylidene]pentanoate CAS Name: (5Z)-5-[(3S,4R)-3-acetamido-4-benzamido-2-thiolanylidene]pentanoic acid methyl ester IUPAC Name: methyl (5Z)-5-[(3S,4R)-3-acetamido-4-benzamidothiolan-2-ylidene]pentanoate Traditional Name: (5Z)-5-[(3S,4R)-3-acetamido-4-benzamido-tetrahydrothiophen-2-ylidene]valeric acid methyl ester Formula: C19H24N2O4S MolecularWeight: 376.46986

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(CSC1=CCCCC(=O)OC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)N[C@H]\1[C@H](CS/C1=C\CCCC(=O)OC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H24N2O4S/c1-13(22)20-18-15(21-19(24)14-8-4-3-5-9-14)12-26-16(18)10-6-7-11-17(23)25-2/h3-5,8-10,15,18H,6-7,11-12H2,1-2H3,(H,20,22)(H,21,24)/b16-10-/t15-,18-/m0/s1