3-[[(2R)-2-azanyl-3-sulfanyl-propyl]amino]-N-(2,3-dimethylphenyl)-4-methoxy-benzamide dihydrochloride

Systemtic Name: 3-[[(2R)-2-azanyl-3-sulfanyl-propyl]amino]-N-(2,3-dimethylphenyl)-4-methoxy-benzamide dihydrochloride Openeye Name: 3-[[(2R)-2-amino-3-sulfanyl-propyl]amino]-N-(2,3-dimethylphenyl)-4-methoxy-benzamide dihydrochloride CAS Name: 3-[[(2R)-2-amino-3-mercaptopropyl]amino]-N-(2,3-dimethylphenyl)-4-methoxybenzamide dihydrochloride IUPAC Name: 3-[[(2R)-2-amino-3-sulfanylpropyl]amino]-N-(2,3-dimethylphenyl)-4-methoxybenzamide dihydrochloride Traditional Name: 3-[[(2R)-2-amino-3-mercapto-propyl]amino]-N-(2,3-dimethylphenyl)-4-methoxy-benzamide dihydrochloride Formula: C19H27Cl2N3O2S MolecularWeight: 432.40758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2=CC(=C(C=C2)OC)NCC(CS)N)C.Cl.Cl

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C2=CC(=C(C=C2)OC)NC[C@H](CS)N)C.Cl.Cl

InChI

InChI=1S/C19H25N3O2S.2ClH/c1-12-5-4-6-16(13(12)2)22-19(23)14-7-8-18(24-3)17(9-14)21-10-15(20)11-25;;/h4-9,15,21,25H,10-11,20H2,1-3H3,(H,22,23);2*1H/t15-;;/m1../s1