(2S)-3-azanyl-N2-(4-bromophenyl)-5-(4-ethoxyphenyl)imino-2H-thiophene-2,4-dicarboxamide

Systemtic Name: (2S)-3-azanyl-N2-(4-bromophenyl)-5-(4-ethoxyphenyl)imino-2H-thiophene-2,4-dicarboxamide Openeye Name: (2S)-3-amino-N2-(4-bromophenyl)-5-(4-ethoxyphenyl)imino-2H-thiophene-2,4-dicarboxamide CAS Name: (2S)-3-amino-N2-(4-bromophenyl)-5-(4-ethoxyphenyl)imino-2H-thiophene-2,4-dicarboxamide IUPAC Name: (2S)-3-amino-2-N-(4-bromophenyl)-5-(4-ethoxyphenyl)imino-2H-thiophene-2,4-dicarboxamide Traditional Name: (2S)-3-amino-N-(4-bromophenyl)-5-p-phenetylimino-2H-thiophene-2,4-dicarboxamide Formula: C20H19BrN4O3S MolecularWeight: 475.35886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N=C2C(=C(C(S2)C(=O)NC3=CC=C(C=C3)Br)N)C(=O)N

Isomeric SMILES

CCOC1=CC=C(C=C1)N=C2C(=C([C@H](S2)C(=O)NC3=CC=C(C=C3)Br)N)C(=O)N

InChI

InChI=1S/C20H19BrN4O3S/c1-2-28-14-9-7-13(8-10-14)25-20-15(18(23)26)16(22)17(29-20)19(27)24-12-5-3-11(21)4-6-12/h3-10,17H,2,22H2,1H3,(H2,23,26)(H,24,27)/t17-/m0/s1