2-[(6-chloranyl-3-oxidanylidene-4-pentan-3-yl-pyrazin-2-yl)amino]-3,5-dimethyl-benzenecarbonitrile

Systemtic Name: 2-[(6-chloranyl-3-oxidanylidene-4-pentan-3-yl-pyrazin-2-yl)amino]-3,5-dimethyl-benzenecarbonitrile Openeye Name: 2-[[6-chloro-4-(1-ethylpropyl)-3-oxo-pyrazin-2-yl]amino]-3,5-dimethyl-benzonitrile CAS Name: 2-[(6-chloro-3-oxo-4-pentan-3-yl-2-pyrazinyl)amino]-3,5-dimethylbenzonitrile IUPAC Name: 2-[(6-chloro-3-oxo-4-pentan-3-ylpyrazin-2-yl)amino]-3,5-dimethylbenzonitrile Traditional Name: 2-[[6-chloro-4-(1-ethylpropyl)-3-keto-pyrazin-2-yl]amino]-3,5-dimethyl-benzonitrile Formula: C18H21ClN4O MolecularWeight: 344.83854

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C=C(N=C(C1=O)NC2=C(C=C(C=C2C#N)C)C)Cl

Isomeric SMILES

CCC(CC)N1C=C(N=C(C1=O)NC2=C(C=C(C=C2C#N)C)C)Cl

InChI

InChI=1S/C18H21ClN4O/c1-5-14(6-2)23-10-15(19)21-17(18(23)24)22-16-12(4)7-11(3)8-13(16)9-20/h7-8,10,14H,5-6H2,1-4H3,(H,21,22)