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N-(2-bromophenyl)-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]propanamide
N-(2-bromophenyl)-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]propanamide
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Descriptors Computed from Structure
Canonical SMILES:
CC1CCC2=C(C1)C=C(C(=N2)SC(C)C(=O)NC3=CC=CC=C3Br)C#N
Isomeric SMILES
CC1CCC2=C(C1)C=C(C(=N2)SC(C)C(=O)NC3=CC=CC=C3Br)C#N
InChI
InChI=1S/C20H20BrN3OS/c1-12-7-8-17-14(9-12)10-15(11-22)20(24-17)26-13(2)19(25)23-18-6-4-3-5-16(18)21/h3-6,10,12-13H,7-9H2,1-2H3,(H,23,25)
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