5-[[(1R,2S)-2-azanylcyclohexyl]amino]-3-[(3-methoxyphenyl)amino]pyrazine-2-carboxamide

Systemtic Name: 5-[[(1R,2S)-2-azanylcyclohexyl]amino]-3-[(3-methoxyphenyl)amino]pyrazine-2-carboxamide Openeye Name: 5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-(3-methoxyanilino)pyrazine-2-carboxamide CAS Name: 5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-(3-methoxyanilino)-2-pyrazinecarboxamide IUPAC Name: 5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-(3-methoxyanilino)pyrazine-2-carboxamide Traditional Name: 5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-(m-anisidino)pyrazinamide Formula: C18H24N6O2 MolecularWeight: 356.42216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NC(=CN=C2C(=O)N)NC3CCCCC3N

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NC(=CN=C2C(=O)N)N[C@@H]3CCCC[C@@H]3N

InChI

InChI=1S/C18H24N6O2/c1-26-12-6-4-5-11(9-12)22-18-16(17(20)25)21-10-15(24-18)23-14-8-3-2-7-13(14)19/h4-6,9-10,13-14H,2-3,7-8,19H2,1H3,(H2,20,25)(H2,22,23,24)/t13-,14+/m0/s1