(1S)-N-(1,3-benzothiazol-2-ylmethyl)-1-(2-methoxy-5-methyl-phenyl)ethanamine

Systemtic Name: (1S)-N-(1,3-benzothiazol-2-ylmethyl)-1-(2-methoxy-5-methyl-phenyl)ethanamine Openeye Name: (1S)-N-(1,3-benzothiazol-2-ylmethyl)-1-(2-methoxy-5-methyl-phenyl)ethanamine CAS Name: (1S)-N-(1,3-benzothiazol-2-ylmethyl)-1-(2-methoxy-5-methylphenyl)ethanamine IUPAC Name: (1S)-N-(1,3-benzothiazol-2-ylmethyl)-1-(2-methoxy-5-methylphenyl)ethanamine Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]amine Formula: C18H20N2OS MolecularWeight: 312.4292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(C)NCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC(=C(C=C1)OC)[C@H](C)NCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H20N2OS/c1-12-8-9-16(21-3)14(10-12)13(2)19-11-18-20-15-6-4-5-7-17(15)22-18/h4-10,13,19H,11H2,1-3H3/t13-/m0/s1