methyl 2-chloranyl-4-[1-(cyclohexylamino)-1-oxidanylidene-butan-2-yl]thieno[3,2-b]pyrrole-5-carboxylate

Systemtic Name: methyl 2-chloranyl-4-[1-(cyclohexylamino)-1-oxidanylidene-butan-2-yl]thieno[3,2-b]pyrrole-5-carboxylate Openeye Name: methyl 2-chloro-4-[1-(cyclohexylcarbamoyl)propyl]thieno[3,2-b]pyrrole-5-carboxylate CAS Name: 2-chloro-4-[1-(cyclohexylamino)-1-oxobutan-2-yl]-5-thieno[3,2-b]pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 2-chloro-4-[1-(cyclohexylamino)-1-oxobutan-2-yl]thieno[3,2-b]pyrrole-5-carboxylate Traditional Name: 2-chloro-4-[1-(cyclohexylcarbamoyl)propyl]thieno[3,2-b]pyrrole-5-carboxylic acid methyl ester Formula: C18H23ClN2O3S MolecularWeight: 382.90482

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1CCCCC1)N2C(=CC3=C2C=C(S3)Cl)C(=O)OC

Isomeric SMILES

CCC(C(=O)NC1CCCCC1)N2C(=CC3=C2C=C(S3)Cl)C(=O)OC

InChI

InChI=1S/C18H23ClN2O3S/c1-3-12(17(22)20-11-7-5-4-6-8-11)21-13-10-16(19)25-15(13)9-14(21)18(23)24-2/h9-12H,3-8H2,1-2H3,(H,20,22)