N-[2-chloranyl-5-[[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]carbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-chloranyl-5-[[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]carbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[2-chloro-5-[[(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]carbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[2-chloro-5-[oxo-[[(2S)-1-oxo-1-(propylamino)propan-2-yl]amino]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-chloro-5-[[(2S)-1-oxo-1-(propylamino)propan-2-yl]carbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[2-chloro-5-[[(1S)-2-keto-1-methyl-2-(propylamino)ethyl]carbamoyl]phenyl]thiophene-2-carboxamide Formula: C18H20ClN3O3S MolecularWeight: 393.8877

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=CC=CS2

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=CC=CS2

InChI

InChI=1S/C18H20ClN3O3S/c1-3-8-20-16(23)11(2)21-17(24)12-6-7-13(19)14(10-12)22-18(25)15-5-4-9-26-15/h4-7,9-11H,3,8H2,1-2H3,(H,20,23)(H,21,24)(H,22,25)/t11-/m0/s1