ethyl 2-[2-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-methyl-amino]ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-methyl-amino]ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-methyl-amino]acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-methylamino]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-methylamino]acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-methyl-amino]acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C24H29N5O5S MolecularWeight: 499.58256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C)CC(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OCC)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C)CC(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OCC)N

InChI

InChI=1S/C24H29N5O5S/c1-4-6-12-29-20(25)19(21(31)27-24(29)33)28(3)13-17(30)26-22-18(23(32)34-5-2)16(14-35-22)15-10-8-7-9-11-15/h7-11,14H,4-6,12-13,25H2,1-3H3,(H,26,30)(H,27,31,33)