N-[(E)-[4-[(4-chlorophenyl)methylamino]-4-oxidanylidene-butan-2-ylidene]amino]pyrazine-2-carboxamide

Systemtic Name: N-[(E)-[4-[(4-chlorophenyl)methylamino]-4-oxidanylidene-butan-2-ylidene]amino]pyrazine-2-carboxamide Openeye Name: N-[(E)-[3-[(4-chlorophenyl)methylamino]-1-methyl-3-oxo-propylidene]amino]pyrazine-2-carboxamide CAS Name: N-[(E)-[4-[(4-chlorophenyl)methylamino]-4-oxobutan-2-ylidene]amino]-2-pyrazinecarboxamide IUPAC Name: N-[(E)-[4-[(4-chlorophenyl)methylamino]-4-oxobutan-2-ylidene]amino]pyrazine-2-carboxamide Traditional Name: N-[(E)-[3-[(4-chlorobenzyl)amino]-3-keto-1-methyl-propylidene]amino]pyrazinamide Formula: C16H16ClN5O2 MolecularWeight: 345.78354

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NC=CN=C1)CC(=O)NCC2=CC=C(C=C2)Cl

Isomeric SMILES

C/C(=N\NC(=O)C1=NC=CN=C1)/CC(=O)NCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H16ClN5O2/c1-11(21-22-16(24)14-10-18-6-7-19-14)8-15(23)20-9-12-2-4-13(17)5-3-12/h2-7,10H,8-9H2,1H3,(H,20,23)(H,22,24)/b21-11+