propan-2-yl 2-[2-(4-cyclopropylcarbonylpiperazin-1-yl)propanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: propan-2-yl 2-[2-(4-cyclopropylcarbonylpiperazin-1-yl)propanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: isopropyl 2-[2-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanoylamino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[2-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-1-oxopropyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[2-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[2-[4-(cyclopropanecarbonyl)piperazino]propanoylamino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid isopropyl ester Formula: C24H35N3O4S MolecularWeight: 461.6174

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)OC(C)C)NC(=O)C(C)N3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)OC(C)C)NC(=O)C(C)N3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C24H35N3O4S/c1-14(2)31-24(30)20-18-8-5-15(3)13-19(18)32-22(20)25-21(28)16(4)26-9-11-27(12-10-26)23(29)17-6-7-17/h14-17H,5-13H2,1-4H3,(H,25,28)