N-[(E)-[4-[(3-chloranyl-2-methyl-phenyl)amino]-4-oxidanylidene-butan-2-ylidene]amino]pyrazine-2-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CC(=NNC(=O)C2=NC=CN=C2)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C/C(=N/NC(=O)C2=NC=CN=C2)/C

InChI

InChI=1S/C16H16ClN5O2/c1-10(21-22-16(24)14-9-18-6-7-19-14)8-15(23)20-13-5-3-4-12(17)11(13)2/h3-7,9H,8H2,1-2H3,(H,20,23)(H,22,24)/b21-10+