(2S)-2-azanyl-N-[4-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]propanamide hydrochloride

Systemtic Name: (2S)-2-azanyl-N-[4-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]propanamide hydrochloride Openeye Name: (2S)-2-amino-N-[4-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]propanamide hydrochloride CAS Name: (2S)-2-amino-N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]propanamide hydrochloride IUPAC Name: (2S)-2-amino-N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]propanamide hydrochloride Traditional Name: (2S)-2-amino-N-[4-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]propionamide hydrochloride Formula: C17H18ClN3OS MolecularWeight: 347.86232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)NC(=O)C(C)N.Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)NC(=O)[C@H](C)N.Cl

InChI

InChI=1S/C17H17N3OS.ClH/c1-10-9-12(7-8-13(10)19-16(21)11(2)18)17-20-14-5-3-4-6-15(14)22-17;/h3-9,11H,18H2,1-2H3,(H,19,21);1H/t11-;/m0./s1