N-[(Z)-[4-(3-morpholin-4-ium-4-ylpropylamino)-4-oxidanylidene-butan-2-ylidene]amino]pyrazine-2-carboxamide

Systemtic Name: N-[(Z)-[4-(3-morpholin-4-ium-4-ylpropylamino)-4-oxidanylidene-butan-2-ylidene]amino]pyrazine-2-carboxamide Openeye Name: N-[(Z)-[1-methyl-3-(3-morpholin-4-ium-4-ylpropylamino)-3-oxo-propylidene]amino]pyrazine-2-carboxamide CAS Name: N-[(Z)-[4-[3-(4-morpholin-4-iumyl)propylamino]-4-oxobutan-2-ylidene]amino]-2-pyrazinecarboxamide IUPAC Name: N-[(Z)-[4-(3-morpholin-4-ium-4-ylpropylamino)-4-oxobutan-2-ylidene]amino]pyrazine-2-carboxamide Traditional Name: N-[(Z)-[3-keto-1-methyl-3-(3-morpholin-4-ium-4-ylpropylamino)propylidene]amino]pyrazinamide Formula: C16H25N6O3+ MolecularWeight: 349.4081

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NC=CN=C1)CC(=O)NCCC[NH+]2CCOCC2

Isomeric SMILES

C/C(=N/NC(=O)C1=NC=CN=C1)/CC(=O)NCCC[NH+]2CCOCC2

InChI

InChI=1S/C16H24N6O3/c1-13(20-21-16(24)14-12-17-4-5-18-14)11-15(23)19-3-2-6-22-7-9-25-10-8-22/h4-5,12H,2-3,6-11H2,1H3,(H,19,23)(H,21,24)/p+1/b20-13-