N-[3-[[(2R)-2-azanyl-3-sulfanyl-propyl]amino]phenyl]-2,3-dimethyl-benzamide dihydrochloride

Systemtic Name: N-[3-[[(2R)-2-azanyl-3-sulfanyl-propyl]amino]phenyl]-2,3-dimethyl-benzamide dihydrochloride Openeye Name: N-[3-[[(2R)-2-amino-3-sulfanyl-propyl]amino]phenyl]-2,3-dimethyl-benzamide dihydrochloride CAS Name: N-[3-[[(2R)-2-amino-3-mercaptopropyl]amino]phenyl]-2,3-dimethylbenzamide dihydrochloride IUPAC Name: N-[3-[[(2R)-2-amino-3-sulfanylpropyl]amino]phenyl]-2,3-dimethylbenzamide dihydrochloride Traditional Name: N-[3-[[(2R)-2-amino-3-mercapto-propyl]amino]phenyl]-2,3-dimethyl-benzamide dihydrochloride Formula: C18H25Cl2N3OS MolecularWeight: 402.3816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1C)C(=O)NC2=CC(=CC=C2)NCC(CS)N.Cl.Cl

Isomeric SMILES

CC1=CC=CC(=C1C)C(=O)NC2=CC(=CC=C2)NC[C@H](CS)N.Cl.Cl

InChI

InChI=1S/C18H23N3OS.2ClH/c1-12-5-3-8-17(13(12)2)18(22)21-16-7-4-6-15(9-16)20-10-14(19)11-23;;/h3-9,14,20,23H,10-11,19H2,1-2H3,(H,21,22);2*1H/t14-;;/m1../s1