1-(3-ethylpentylamino)-4-methyl-thioxanthen-9-one

Systemtic Name: 1-(3-ethylpentylamino)-4-methyl-thioxanthen-9-one Openeye Name: 1-(3-ethylpentylamino)-4-methyl-thioxanthen-9-one CAS Name: 1-(3-ethylpentylamino)-4-methyl-9-thioxanthenone IUPAC Name: 1-(3-ethylpentylamino)-4-methylthioxanthen-9-one Traditional Name: 1-(3-ethylpentylamino)-4-methyl-thioxanthen-9-one Formula: C21H25NOS MolecularWeight: 339.4943

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CCNC1=C2C(=C(C=C1)C)SC3=CC=CC=C3C2=O

Isomeric SMILES

CCC(CC)CCNC1=C2C(=C(C=C1)C)SC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H25NOS/c1-4-15(5-2)12-13-22-17-11-10-14(3)21-19(17)20(23)16-8-6-7-9-18(16)24-21/h6-11,15,22H,4-5,12-13H2,1-3H3