[1-[(9-ethylcarbazol-3-yl)amino]-1-oxidanylidene-butan-2-yl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: [1-[(9-ethylcarbazol-3-yl)amino]-1-oxidanylidene-butan-2-yl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: 1-[(9-ethylcarbazol-3-yl)carbamoyl]propyl 4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid [1-[(9-ethyl-3-carbazolyl)amino]-1-oxobutan-2-yl] ester IUPAC Name: [1-[(9-ethylcarbazol-3-yl)amino]-1-oxobutan-2-yl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid 1-[(9-ethylcarbazol-3-yl)carbamoyl]propyl ester Formula: C27H28N2O3S MolecularWeight: 460.58782

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC2=C(C=C1)N(C3=CC=CC=C32)CC)OC(=O)C4=CC5=C(S4)CCCC5

Isomeric SMILES

CCC(C(=O)NC1=CC2=C(C=C1)N(C3=CC=CC=C32)CC)OC(=O)C4=CC5=C(S4)CCCC5

InChI

InChI=1S/C27H28N2O3S/c1-3-23(32-27(31)25-15-17-9-5-8-12-24(17)33-25)26(30)28-18-13-14-22-20(16-18)19-10-6-7-11-21(19)29(22)4-2/h6-7,10-11,13-16,23H,3-5,8-9,12H2,1-2H3,(H,28,30)