S-(ethylamino) N-[[3-[(5-bromanyl-2-methoxy-phenyl)carbonylamino]-7-methoxy-3,4-dihydro-2H-chromen-6-yl]sulfonyl]carbamothioate

Systemtic Name: S-(ethylamino) N-[[3-[(5-bromanyl-2-methoxy-phenyl)carbonylamino]-7-methoxy-3,4-dihydro-2H-chromen-6-yl]sulfonyl]carbamothioate Openeye Name: S-(ethylamino) N-[3-[(5-bromo-2-methoxy-benzoyl)amino]-7-methoxy-chroman-6-yl]sulfonylcarbamothioate CAS Name: N-[[3-[[(5-bromo-2-methoxyphenyl)-oxomethyl]amino]-7-methoxy-3,4-dihydro-2H-1-benzopyran-6-yl]sulfonyl]carbamothioic acid S-(ethylamino) ester IUPAC Name: S-(ethylamino) N-[[3-[(5-bromo-2-methoxybenzoyl)amino]-7-methoxy-3,4-dihydro-2H-chromen-6-yl]sulfonyl]carbamothioate Traditional Name: N-[3-[(5-bromo-2-methoxy-benzoyl)amino]-7-methoxy-chroman-6-yl]sulfonylthiocarbamic acid S-(ethylamino) ester Formula: C21H24BrN3O7S2 MolecularWeight: 574.46516

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Descriptors Computed from Structure

Canonical SMILES:

CCNSC(=O)NS(=O)(=O)C1=C(C=C2C(=C1)CC(CO2)NC(=O)C3=C(C=CC(=C3)Br)OC)OC

Isomeric SMILES

CCNSC(=O)NS(=O)(=O)C1=C(C=C2C(=C1)CC(CO2)NC(=O)C3=C(C=CC(=C3)Br)OC)OC

InChI

InChI=1S/C21H24BrN3O7S2/c1-4-23-33-21(27)25-34(28,29)19-8-12-7-14(11-32-17(12)10-18(19)31-3)24-20(26)15-9-13(22)5-6-16(15)30-2/h5-6,8-10,14,23H,4,7,11H2,1-3H3,(H,24,26)(H,25,27)