propan-2-yl 2-(butan-2-ylcarbamoylamino)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: propan-2-yl 2-(butan-2-ylcarbamoylamino)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: isopropyl 6-phenyl-2-(sec-butylcarbamoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[(butan-2-ylamino)-oxomethyl]amino]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-(butan-2-ylcarbamoylamino)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 6-phenyl-2-(sec-butylcarbamoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid isopropyl ester Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC1=C(C2=C(S1)CC(CC2)C3=CC=CC=C3)C(=O)OC(C)C

Isomeric SMILES

CCC(C)NC(=O)NC1=C(C2=C(S1)CC(CC2)C3=CC=CC=C3)C(=O)OC(C)C

InChI

InChI=1S/C23H30N2O3S/c1-5-15(4)24-23(27)25-21-20(22(26)28-14(2)3)18-12-11-17(13-19(18)29-21)16-9-7-6-8-10-16/h6-10,14-15,17H,5,11-13H2,1-4H3,(H2,24,25,27)