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

Systemtic Name: (2S)-2-azanyl-N-[4-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]propanamide Openeye Name: (2S)-2-amino-N-[4-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]propanamide CAS Name: (2S)-2-amino-N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]propanamide IUPAC Name: (2S)-2-amino-N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]propanamide Traditional Name: (2S)-2-amino-N-[4-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]propionamide Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3OS/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)/t11-/m0/s1