2-[(4-bromophenyl)carbamoyl-prop-2-enyl-amino]-N-[(1-methylpyrrol-2-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(4-bromophenyl)carbamoyl-prop-2-enyl-amino]-N-[(1-methylpyrrol-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: 2-[allyl-[(4-bromophenyl)carbamoyl]amino]-N-benzyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: 2-[[(4-bromoanilino)-oxomethyl]-prop-2-enylamino]-N-[(1-methyl-2-pyrrolyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(4-bromophenyl)carbamoyl-prop-2-enylamino]-N-[(1-methylpyrrol-2-yl)methyl]acetamide Traditional Name: 2-[allyl-[(4-bromophenyl)carbamoyl]amino]-N-benzyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C25H27BrN4O2 MolecularWeight: 495.41148

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(CC2=CC=CC=C2)C(=O)CN(CC=C)C(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CN1C=CC=C1CN(CC2=CC=CC=C2)C(=O)CN(CC=C)C(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C25H27BrN4O2/c1-3-15-29(25(32)27-22-13-11-21(26)12-14-22)19-24(31)30(17-20-8-5-4-6-9-20)18-23-10-7-16-28(23)2/h3-14,16H,1,15,17-19H2,2H3,(H,27,32)