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

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-N-propan-2-yl-thiophene-2-carboxamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxo-ethyl]-N-isopropyl-thiophene-2-carboxamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-butylamino]-2-oxoethyl]-N-propan-2-yl-2-thiophenecarboxamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butylamino]-2-oxoethyl]-N-propan-2-ylthiophene-2-carboxamide Traditional Name: N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-butyl-amino]-2-keto-ethyl]-N-isopropyl-thiophene-2-carboxamide Formula: C26H32BrN3O2S MolecularWeight: 530.52018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)CN(C(C)C)C(=O)C3=CC=CS3

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)CN(C(C)C)C(=O)C3=CC=CS3

InChI

InChI=1S/C26H32BrN3O2S/c1-4-5-14-29(25(31)19-30(20(2)3)26(32)24-9-7-16-33-24)18-23-8-6-15-28(23)17-21-10-12-22(27)13-11-21/h6-13,15-16,20H,4-5,14,17-19H2,1-3H3