(3S)-2-[(2-tert-butyl-1,3-thiazol-4-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3S)-2-[(2-tert-butyl-1,3-thiazol-4-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3S)-2-[(2-tert-butylthiazol-4-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3S)-2-[(2-tert-butyl-4-thiazolyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3S)-2-[(2-tert-butyl-1,3-thiazol-4-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3S)-2-[(2-tert-butylthiazol-4-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C18H23N3OS MolecularWeight: 329.45972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=CS1)CN2CC3=CC=CC=C3CC2C(=O)N

Isomeric SMILES

CC(C)(C)C1=NC(=CS1)CN2CC3=CC=CC=C3C[C@H]2C(=O)N

InChI

InChI=1S/C18H23N3OS/c1-18(2,3)17-20-14(11-23-17)10-21-9-13-7-5-4-6-12(13)8-15(21)16(19)22/h4-7,11,15H,8-10H2,1-3H3,(H2,19,22)/t15-/m0/s1