2-[2-aminocarbonyl-2-[4-[(E)-thiomorpholin-4-yliminomethyl]phenyl]-3,4-dihydrochromen-3-yl]ethanoate

Systemtic Name: 2-[2-aminocarbonyl-2-[4-[(E)-thiomorpholin-4-yliminomethyl]phenyl]-3,4-dihydrochromen-3-yl]ethanoate Openeye Name: 2-[2-carbamoyl-2-[4-[(E)-thiomorpholinoiminomethyl]phenyl]chroman-3-yl]acetate CAS Name: 2-[2-carbamoyl-2-[4-[(E)-thiomorpholin-4-yliminomethyl]phenyl]-3,4-dihydro-2H-1-benzopyran-3-yl]acetate IUPAC Name: 2-[2-carbamoyl-2-[4-[(E)-thiomorpholin-4-yliminomethyl]phenyl]-3,4-dihydrochromen-3-yl]acetate Traditional Name: 2-[2-carbamoyl-2-[4-[(E)-thiomorpholinoiminomethyl]phenyl]chroman-3-yl]acetate Formula: C23H24N3O4S- MolecularWeight: 438.51936

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1N=CC2=CC=C(C=C2)C3(C(CC4=CC=CC=C4O3)CC(=O)[O-])C(=O)N

Isomeric SMILES

C1CSCCN1/N=C/C2=CC=C(C=C2)C3(C(CC4=CC=CC=C4O3)CC(=O)[O-])C(=O)N

InChI

InChI=1S/C23H25N3O4S/c24-22(29)23(19(14-21(27)28)13-17-3-1-2-4-20(17)30-23)18-7-5-16(6-8-18)15-25-26-9-11-31-12-10-26/h1-8,15,19H,9-14H2,(H2,24,29)(H,27,28)/p-1/b25-15+