3-bromanyl-N-butan-2-yl-N-[2-[(3-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3-bromanyl-N-butan-2-yl-N-[2-[(3-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: N-[2-[benzyl-[(3-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-3-bromo-N-sec-butyl-benzamide CAS Name: 3-bromo-N-butan-2-yl-N-[2-[(3-methyl-2-thiophenyl)methyl-(phenylmethyl)amino]-2-oxoethyl]benzamide IUPAC Name: N-[2-[benzyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-3-bromo-N-butan-2-ylbenzamide Traditional Name: N-[2-[benzyl-[(3-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]-3-bromo-N-sec-butyl-benzamide Formula: C26H29BrN2O2S MolecularWeight: 513.48966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(=O)N(CC1=CC=CC=C1)CC2=C(C=CS2)C)C(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCC(C)N(CC(=O)N(CC1=CC=CC=C1)CC2=C(C=CS2)C)C(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C26H29BrN2O2S/c1-4-20(3)29(26(31)22-11-8-12-23(27)15-22)18-25(30)28(16-21-9-6-5-7-10-21)17-24-19(2)13-14-32-24/h5-15,20H,4,16-18H2,1-3H3