methyl 5-methyl-2-[[4-(oxolan-2-ylcarbonyl)piperazin-1-yl]carbothioylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-2-[[4-(oxolan-2-ylcarbonyl)piperazin-1-yl]carbothioylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 5-methyl-4-phenyl-2-[[4-(tetrahydrofuran-2-carbonyl)piperazine-1-carbothioyl]amino]thiophene-3-carboxylate CAS Name: 5-methyl-2-[[[4-[oxo(2-oxolanyl)methyl]-1-piperazinyl]-sulfanylidenemethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-2-[[4-(oxolane-2-carbonyl)piperazine-1-carbothioyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 5-methyl-4-phenyl-2-[[4-(tetrahydrofuran-2-carbonyl)piperazine-1-carbothioyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C23H27N3O4S2 MolecularWeight: 473.60818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=S)N2CCN(CC2)C(=O)C3CCCO3)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C(S1)NC(=S)N2CCN(CC2)C(=O)C3CCCO3)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C23H27N3O4S2/c1-15-18(16-7-4-3-5-8-16)19(22(28)29-2)20(32-15)24-23(31)26-12-10-25(11-13-26)21(27)17-9-6-14-30-17/h3-5,7-8,17H,6,9-14H2,1-2H3,(H,24,31)