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N-(3-cyanothiophen-2-yl)-3-[methyl-[1-(3-nitrophenyl)ethyl]amino]propanamide
N-(3-cyanothiophen-2-yl)-3-[methyl-[1-(3-nitrophenyl)ethyl]amino]propanamide
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Descriptors Computed from Structure
Canonical SMILES:
CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)CCC(=O)NC2=C(C=CS2)C#N
Isomeric SMILES
CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)CCC(=O)NC2=C(C=CS2)C#N
InChI
InChI=1S/C17H18N4O3S/c1-12(13-4-3-5-15(10-13)21(23)24)20(2)8-6-16(22)19-17-14(11-18)7-9-25-17/h3-5,7,9-10,12H,6,8H2,1-2H3,(H,19,22)
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