ethyl N-[2-oxidanylidene-4-[[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]chromen-7-yl]carbamate

Systemtic Name: ethyl N-[2-oxidanylidene-4-[[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]chromen-7-yl]carbamate Openeye Name: ethyl N-[2-oxo-4-[[4-(3-thienylmethyl)piperazin-1-yl]methyl]chromen-7-yl]carbamate CAS Name: N-[2-oxo-4-[[4-(3-thiophenylmethyl)-1-piperazinyl]methyl]-1-benzopyran-7-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-oxo-4-[[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]chromen-7-yl]carbamate Traditional Name: N-[2-keto-4-[[4-(3-thenyl)piperazino]methyl]chromen-7-yl]carbamic acid ethyl ester Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)CC4=CSC=C4

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)CC4=CSC=C4

InChI

InChI=1S/C22H25N3O4S/c1-2-28-22(27)23-18-3-4-19-17(11-21(26)29-20(19)12-18)14-25-8-6-24(7-9-25)13-16-5-10-30-15-16/h3-5,10-12,15H,2,6-9,13-14H2,1H3,(H,23,27)