2,4-bis(chloranyl)-N-[1-[(3-ethynylphenyl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[1-[(3-ethynylphenyl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]benzamide Openeye Name: 2,4-dichloro-N-[1-[(3-ethynylphenyl)carbamoyl]-3-methyl-butyl]benzamide CAS Name: 2,4-dichloro-N-[1-(3-ethynylanilino)-4-methyl-1-oxopentan-2-yl]benzamide IUPAC Name: 2,4-dichloro-N-[1-(3-ethynylanilino)-4-methyl-1-oxopentan-2-yl]benzamide Traditional Name: 2,4-dichloro-N-[1-[(3-ethynylphenyl)carbamoyl]-3-methyl-butyl]benzamide Formula: C21H20Cl2N2O2 MolecularWeight: 403.3017

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=CC(=C1)C#C)NC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)CC(C(=O)NC1=CC=CC(=C1)C#C)NC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C21H20Cl2N2O2/c1-4-14-6-5-7-16(11-14)24-21(27)19(10-13(2)3)25-20(26)17-9-8-15(22)12-18(17)23/h1,5-9,11-13,19H,10H2,2-3H3,(H,24,27)(H,25,26)