1-[9,10-bis(oxidanylidene)anthracen-1-yl]-3-phenethyl-thiourea

Systemtic Name: 1-[9,10-bis(oxidanylidene)anthracen-1-yl]-3-phenethyl-thiourea Openeye Name: 1-(9,10-dioxo-1-anthryl)-3-phenethyl-thiourea CAS Name: 1-(9,10-dioxo-1-anthracenyl)-3-phenethylthiourea IUPAC Name: 1-(9,10-dioxoanthracen-1-yl)-3-phenethylthiourea Traditional Name: 1-(9,10-diketo-1-anthryl)-3-phenethyl-thiourea Formula: C23H18N2O2S MolecularWeight: 386.46622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H18N2O2S/c26-21-16-9-4-5-10-17(16)22(27)20-18(21)11-6-12-19(20)25-23(28)24-14-13-15-7-2-1-3-8-15/h1-12H,13-14H2,(H2,24,25,28)