N-[(4-iodophenyl)methyl]-3-methoxy-4-(pyrazin-2-ylcarbamoylamino)benzamide

Systemtic Name: N-[(4-iodophenyl)methyl]-3-methoxy-4-(pyrazin-2-ylcarbamoylamino)benzamide Openeye Name: N-[(4-iodophenyl)methyl]-3-methoxy-4-(pyrazin-2-ylcarbamoylamino)benzamide CAS Name: N-[(4-iodophenyl)methyl]-3-methoxy-4-[[oxo-(2-pyrazinylamino)methyl]amino]benzamide IUPAC Name: N-[(4-iodophenyl)methyl]-3-methoxy-4-(pyrazin-2-ylcarbamoylamino)benzamide Traditional Name: N-(4-iodobenzyl)-3-methoxy-4-(pyrazin-2-ylcarbamoylamino)benzamide Formula: C20H18IN5O3 MolecularWeight: 503.29309

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NCC2=CC=C(C=C2)I)NC(=O)NC3=NC=CN=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NCC2=CC=C(C=C2)I)NC(=O)NC3=NC=CN=C3

InChI

InChI=1S/C20H18IN5O3/c1-29-17-10-14(19(27)24-11-13-2-5-15(21)6-3-13)4-7-16(17)25-20(28)26-18-12-22-8-9-23-18/h2-10,12H,11H2,1H3,(H,24,27)(H2,23,25,26,28)