5-methyl-2-[3-[3-[(4-methyl-2-sulfanyl-phenyl)amino]propylamino]propylamino]benzenethiol

Systemtic Name: 5-methyl-2-[3-[3-[(4-methyl-2-sulfanyl-phenyl)amino]propylamino]propylamino]benzenethiol Openeye Name: 5-methyl-2-[3-[3-(4-methyl-2-sulfanyl-anilino)propylamino]propylamino]benzenethiol CAS Name: 2-[3-[3-(2-mercapto-4-methylanilino)propylamino]propylamino]-5-methylbenzenethiol IUPAC Name: 5-methyl-2-[3-[3-(4-methyl-2-sulfanylanilino)propylamino]propylamino]benzenethiol Traditional Name: 2-[3-[3-(2-mercapto-4-methyl-anilino)propylamino]propylamino]-5-methyl-benzenethiol Formula: C20H29N3S2 MolecularWeight: 375.59436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NCCCNCCCNC2=C(C=C(C=C2)C)S)S

Isomeric SMILES

CC1=CC(=C(C=C1)NCCCNCCCNC2=C(C=C(C=C2)C)S)S

InChI

InChI=1S/C20H29N3S2/c1-15-5-7-17(19(24)13-15)22-11-3-9-21-10-4-12-23-18-8-6-16(2)14-20(18)25/h5-8,13-14,21-25H,3-4,9-12H2,1-2H3