3-[[9,10-bis(oxidanylidene)anthracen-2-yl]carbamoyl]-1-butyl-1-methylsulfonyl-urea

Systemtic Name: 3-[[9,10-bis(oxidanylidene)anthracen-2-yl]carbamoyl]-1-butyl-1-methylsulfonyl-urea Openeye Name: 1-butyl-3-[(9,10-dioxo-2-anthryl)carbamoyl]-1-methylsulfonyl-urea CAS Name: 1-butyl-3-[[(9,10-dioxo-2-anthracenyl)amino]-oxomethyl]-1-methylsulfonylurea IUPAC Name: 1-butyl-3-[(9,10-dioxoanthracen-2-yl)carbamoyl]-1-methylsulfonylurea Traditional Name: 1-butyl-3-[(9,10-diketo-2-anthryl)carbamoyl]-1-mesyl-urea Formula: C21H21N3O6S MolecularWeight: 443.47294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(=O)NC(=O)NC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C

Isomeric SMILES

CCCCN(C(=O)NC(=O)NC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C

InChI

InChI=1S/C21H21N3O6S/c1-3-4-11-24(31(2,29)30)21(28)23-20(27)22-13-9-10-16-17(12-13)19(26)15-8-6-5-7-14(15)18(16)25/h5-10,12H,3-4,11H2,1-2H3,(H2,22,23,27,28)