carbamimidoyl-[[8-methoxy-2-methyl-5,5-bis(oxidanylidene)-6H-benzo[c]thiochromen-3-yl]carbonyl]azanium methanoate

Systemtic Name: carbamimidoyl-[[8-methoxy-2-methyl-5,5-bis(oxidanylidene)-6H-benzo[c]thiochromen-3-yl]carbonyl]azanium methanoate Openeye Name: carbamimidoyl-(8-methoxy-2-methyl-5,5-dioxo-6H-benzo[c]thiochromene-3-carbonyl)ammonium formate CAS Name: carbamimidoyl-[(8-methoxy-2-methyl-5,5-dioxo-6H-benzo[c]thiochromen-3-yl)-oxomethyl]ammonium formate IUPAC Name: carbamimidoyl-(8-methoxy-2-methyl-5,5-dioxo-6H-benzo[c]thiochromene-3-carbonyl)azanium formate Traditional Name: amidino-(5,5-diketo-8-methoxy-2-methyl-6H-benzo[c]thiochromene-3-carbonyl)ammonium formate Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C3=C(CS2(=O)=O)C=C(C=C3)OC)C(=O)[NH2+]C(=N)N.C(=O)[O-]

Isomeric SMILES

CC1=C(C=C2C(=C1)C3=C(CS2(=O)=O)C=C(C=C3)OC)C(=O)[NH2+]C(=N)N.C(=O)[O-]

InChI

InChI=1S/C17H17N3O4S.CH2O2/c1-9-5-14-12-4-3-11(24-2)6-10(12)8-25(22,23)15(14)7-13(9)16(21)20-17(18)19;2-1-3/h3-7H,8H2,1-2H3,(H4,18,19,20,21);1H,(H,2,3)