N-[2-[[(1S)-2-(tert-butylamino)-2-oxidanylidene-1-phenyl-ethyl]-prop-2-enyl-amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[[(1S)-2-(tert-butylamino)-2-oxidanylidene-1-phenyl-ethyl]-prop-2-enyl-amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[allyl-[(1S)-2-(tert-butylamino)-2-oxo-1-phenyl-ethyl]amino]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[2-[[(1S)-2-(tert-butylamino)-2-oxo-1-phenylethyl]-prop-2-enylamino]-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[[(1S)-2-(tert-butylamino)-2-oxo-1-phenylethyl]-prop-2-enylamino]-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-[2-[allyl-[(1S)-2-(tert-butylamino)-2-keto-1-phenyl-ethyl]amino]-2-keto-ethyl]thiophene-2-carboxamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(C1=CC=CC=C1)N(CC=C)C(=O)CNC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)(C)NC(=O)[C@H](C1=CC=CC=C1)N(CC=C)C(=O)CNC(=O)C2=CC=CS2

InChI

InChI=1S/C22H27N3O3S/c1-5-13-25(18(26)15-23-20(27)17-12-9-14-29-17)19(16-10-7-6-8-11-16)21(28)24-22(2,3)4/h5-12,14,19H,1,13,15H2,2-4H3,(H,23,27)(H,24,28)/t19-/m0/s1