(2S)-2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-N-(methylcarbamoyl)-2-phenyl-ethanamide

Systemtic Name: (2S)-2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-N-(methylcarbamoyl)-2-phenyl-ethanamide Openeye Name: (2S)-2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-N-(methylcarbamoyl)-2-phenyl-acetamide CAS Name: (2S)-2-[(5-chloro-2-thiophenyl)methyl-prop-2-enylamino]-N-(methylcarbamoyl)-2-phenylacetamide IUPAC Name: (2S)-2-[(5-chlorothiophen-2-yl)methyl-prop-2-enylamino]-N-(methylcarbamoyl)-2-phenylacetamide Traditional Name: (2S)-2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-N-(methylcarbamoyl)-2-phenyl-acetamide Formula: C18H20ClN3O2S MolecularWeight: 377.8883

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)C(C1=CC=CC=C1)N(CC=C)CC2=CC=C(S2)Cl

Isomeric SMILES

CNC(=O)NC(=O)[C@H](C1=CC=CC=C1)N(CC=C)CC2=CC=C(S2)Cl

InChI

InChI=1S/C18H20ClN3O2S/c1-3-11-22(12-14-9-10-15(19)25-14)16(13-7-5-4-6-8-13)17(23)21-18(24)20-2/h3-10,16H,1,11-12H2,2H3,(H2,20,21,23,24)/t16-/m0/s1