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

Systemtic Name: 2-[(4-cyanophenyl)carbamoyl-prop-2-enyl-amino]-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]ethanamide Openeye Name: 2-[allyl-[(4-cyanophenyl)carbamoyl]amino]-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: 2-[[(4-cyanoanilino)-oxomethyl]-prop-2-enylamino]-N-cyclopropyl-N-[(1-methyl-2-pyrrolyl)methyl]acetamide IUPAC Name: 2-[(4-cyanophenyl)carbamoyl-prop-2-enylamino]-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide Traditional Name: 2-[allyl-[(4-cyanophenyl)carbamoyl]amino]-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(C2CC2)C(=O)CN(CC=C)C(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CN1C=CC=C1CN(C2CC2)C(=O)CN(CC=C)C(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H25N5O2/c1-3-12-26(22(29)24-18-8-6-17(14-23)7-9-18)16-21(28)27(19-10-11-19)15-20-5-4-13-25(20)2/h3-9,13,19H,1,10-12,15-16H2,2H3,(H,24,29)