3-azanyl-10,10-bis(oxidanylidene)-6-propyl-thioxanthen-9-one

Systemtic Name: 3-azanyl-10,10-bis(oxidanylidene)-6-propyl-thioxanthen-9-one Openeye Name: 3-amino-10,10-dioxo-6-propyl-thioxanthen-9-one CAS Name: 3-amino-10,10-dioxo-6-propyl-9-thioxanthenone IUPAC Name: 3-amino-10,10-dioxo-6-propylthioxanthen-9-one Traditional Name: 3-amino-10,10-diketo-6-propyl-thioxanthen-9-one Formula: C16H15NO3S MolecularWeight: 301.3602

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1)C(=O)C3=C(S2(=O)=O)C=C(C=C3)N

Isomeric SMILES

CCCC1=CC2=C(C=C1)C(=O)C3=C(S2(=O)=O)C=C(C=C3)N

InChI

InChI=1S/C16H15NO3S/c1-2-3-10-4-6-12-14(8-10)21(19,20)15-9-11(17)5-7-13(15)16(12)18/h4-9H,2-3,17H2,1H3