(4S)-2-(4-ethoxyphenyl)-4-(thiophen-2-ylmethyliminomethyl)-4H-isoquinoline-1,3-dione

Systemtic Name: (4S)-2-(4-ethoxyphenyl)-4-(thiophen-2-ylmethyliminomethyl)-4H-isoquinoline-1,3-dione Openeye Name: (4S)-2-(4-ethoxyphenyl)-4-(2-thienylmethyliminomethyl)-4H-isoquinoline-1,3-dione CAS Name: (4S)-2-(4-ethoxyphenyl)-4-(thiophen-2-ylmethyliminomethyl)-4H-isoquinoline-1,3-dione IUPAC Name: (4S)-2-(4-ethoxyphenyl)-4-(thiophen-2-ylmethyliminomethyl)-4H-isoquinoline-1,3-dione Traditional Name: (4S)-2-p-phenetyl-4-(2-thenyliminomethyl)-4H-isoquinoline-1,3-quinone Formula: C23H20N2O3S MolecularWeight: 404.4815

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(C3=CC=CC=C3C2=O)C=NCC4=CC=CS4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)[C@@H](C3=CC=CC=C3C2=O)C=NCC4=CC=CS4

InChI

InChI=1S/C23H20N2O3S/c1-2-28-17-11-9-16(10-12-17)25-22(26)20-8-4-3-7-19(20)21(23(25)27)15-24-14-18-6-5-13-29-18/h3-13,15,21H,2,14H2,1H3/t21-/m1/s1