[9,10-bis(oxidanylidene)anthracen-2-yl]methyl carbamimidothioate

Systemtic Name: [9,10-bis(oxidanylidene)anthracen-2-yl]methyl carbamimidothioate Openeye Name: 2-[(9,10-dioxo-2-anthryl)methyl]isothiourea CAS Name: carbamimidothioic acid (9,10-dioxo-2-anthracenyl)methyl ester IUPAC Name: (9,10-dioxoanthracen-2-yl)methyl carbamimidothioate Traditional Name: 2-[(9,10-diketo-2-anthryl)methyl]isothiourea Formula: C16H12N2O2S MolecularWeight: 296.34368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)CSC(=N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)CSC(=N)N

InChI

InChI=1S/C16H12N2O2S/c17-16(18)21-8-9-5-6-12-13(7-9)15(20)11-4-2-1-3-10(11)14(12)19/h1-7H,8H2,(H3,17,18)