2-[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-[(E)-3-(2-methylthiazol-4-yl)prop-2-enoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[(E)-3-(2-methyl-4-thiazolyl)-1-oxoprop-2-enyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[(E)-3-(2-methylthiazol-4-yl)acryloyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C=CC(=O)N2CC3=CC=CC=C3CC2C(=O)N

Isomeric SMILES

CC1=NC(=CS1)/C=C/C(=O)N2CC3=CC=CC=C3CC2C(=O)N

InChI

InChI=1S/C17H17N3O2S/c1-11-19-14(10-23-11)6-7-16(21)20-9-13-5-3-2-4-12(13)8-15(20)17(18)22/h2-7,10,15H,8-9H2,1H3,(H2,18,22)/b7-6+