2-[[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoyl]amino]-N-propyl-benzamide

Systemtic Name: 2-[[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoyl]amino]-N-propyl-benzamide Openeye Name: 2-[[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoyl]amino]-N-propyl-benzamide CAS Name: 2-[[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-3-pyrrolyl)-1-oxoprop-2-enyl]amino]-N-propylbenzamide IUPAC Name: 2-[[(E)-2-cyano-3-(2,5-dimethyl-1-propylpyrrol-3-yl)prop-2-enoyl]amino]-N-propylbenzamide Traditional Name: 2-[[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)acryloyl]amino]-N-propyl-benzamide Formula: C23H28N4O2 MolecularWeight: 392.49402

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=O)C(=CC2=C(N(C(=C2)C)CCC)C)C#N

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=O)/C(=C/C2=C(N(C(=C2)C)CCC)C)/C#N

InChI

InChI=1S/C23H28N4O2/c1-5-11-25-23(29)20-9-7-8-10-21(20)26-22(28)19(15-24)14-18-13-16(3)27(12-6-2)17(18)4/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,25,29)(H,26,28)/b19-14+