cyclopentyl (E,2S)-5-[5-[4-aminocarbonyl-5-(aminocarbonylamino)thiophen-2-yl]-2-methyl-phenyl]-2-azanyl-pent-4-enoate

Systemtic Name: cyclopentyl (E,2S)-5-[5-[4-aminocarbonyl-5-(aminocarbonylamino)thiophen-2-yl]-2-methyl-phenyl]-2-azanyl-pent-4-enoate Openeye Name: cyclopentyl (E,2S)-2-amino-5-[5-(4-carbamoyl-5-ureido-2-thienyl)-2-methyl-phenyl]pent-4-enoate CAS Name: (E,2S)-2-amino-5-[5-[4-carbamoyl-5-(carbamoylamino)-2-thiophenyl]-2-methylphenyl]-4-pentenoic acid cyclopentyl ester IUPAC Name: cyclopentyl (E,2S)-2-amino-5-[5-[4-carbamoyl-5-(carbamoylamino)thiophen-2-yl]-2-methylphenyl]pent-4-enoate Traditional Name: (E,2S)-2-amino-5-[5-(4-carbamoyl-5-ureido-2-thienyl)-2-methyl-phenyl]pent-4-enoic acid cyclopentyl ester Formula: C23H28N4O4S MolecularWeight: 456.55782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=C(S2)NC(=O)N)C(=O)N)C=CCC(C(=O)OC3CCCC3)N

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC(=C(S2)NC(=O)N)C(=O)N)/C=C/C[C@@H](C(=O)OC3CCCC3)N

InChI

InChI=1S/C23H28N4O4S/c1-13-9-10-15(19-12-17(20(25)28)21(32-19)27-23(26)30)11-14(13)5-4-8-18(24)22(29)31-16-6-2-3-7-16/h4-5,9-12,16,18H,2-3,6-8,24H2,1H3,(H2,25,28)(H3,26,27,30)/b5-4+/t18-/m0/s1