[2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-(cyclopropylcarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-(cyclopropylcarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 2-(cyclopropanecarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[cyclopropyl(oxo)methyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 2-(cyclopropanecarbonylamino)-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-(cyclopropanecarbonylamino)-4,5-dimethyl-thiophene-3-carboxylic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C23H30N2O4S MolecularWeight: 430.5603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OCC(=O)NC23CC4CC(C2)CC(C4)C3)NC(=O)C5CC5)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OCC(=O)NC23CC4CC(C2)CC(C4)C3)NC(=O)C5CC5)C

InChI

InChI=1S/C23H30N2O4S/c1-12-13(2)30-21(24-20(27)17-3-4-17)19(12)22(28)29-11-18(26)25-23-8-14-5-15(9-23)7-16(6-14)10-23/h14-17H,3-11H2,1-2H3,(H,24,27)(H,25,26)