N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-N-pentyl-thiophene-2-carboxamide

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-N-pentyl-thiophene-2-carboxamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxo-ethyl]-N-pentyl-thiophene-2-carboxamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-butylamino]-2-oxoethyl]-N-pentyl-2-thiophenecarboxamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butylamino]-2-oxoethyl]-N-pentylthiophene-2-carboxamide Traditional Name: N-amyl-N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-butyl-amino]-2-keto-ethyl]thiophene-2-carboxamide Formula: C28H36BrN3O2S MolecularWeight: 558.57334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)N(CCCC)CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)C3=CC=CS3

Isomeric SMILES

CCCCCN(CC(=O)N(CCCC)CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)C3=CC=CS3

InChI

InChI=1S/C28H36BrN3O2S/c1-3-5-7-17-32(28(34)26-11-9-19-35-26)22-27(33)31(16-6-4-2)21-25-10-8-18-30(25)20-23-12-14-24(29)15-13-23/h8-15,18-19H,3-7,16-17,20-22H2,1-2H3