ethyl 5-methyl-2-[[4-[(2R)-oxolan-2-yl]carbonylpiperazin-1-yl]carbothioylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-methyl-2-[[4-[(2R)-oxolan-2-yl]carbonylpiperazin-1-yl]carbothioylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 5-methyl-4-phenyl-2-[[4-[(2R)-tetrahydrofuran-2-carbonyl]piperazine-1-carbothioyl]amino]thiophene-3-carboxylate CAS Name: 5-methyl-2-[[[4-[oxo-[(2R)-2-oxolanyl]methyl]-1-piperazinyl]-sulfanylidenemethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-[[4-[(2R)-oxolane-2-carbonyl]piperazine-1-carbothioyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 5-methyl-4-phenyl-2-[[4-[(2R)-tetrahydrofuran-2-carbonyl]piperazine-1-carbothioyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C24H29N3O4S2 MolecularWeight: 487.63476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=S)N3CCN(CC3)C(=O)C4CCCO4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=S)N3CCN(CC3)C(=O)[C@H]4CCCO4

InChI

InChI=1S/C24H29N3O4S2/c1-3-30-23(29)20-19(17-8-5-4-6-9-17)16(2)33-21(20)25-24(32)27-13-11-26(12-14-27)22(28)18-10-7-15-31-18/h4-6,8-9,18H,3,7,10-15H2,1-2H3,(H,25,32)/t18-/m1/s1