5-azanyl-2-[[4-[(E)-3-imidazol-1-yl-2-(1,3-thiazol-2-yl)prop-1-enyl]-2-phenyl-phenyl]carbonylamino]-5-oxidanylidene-pentanoate

Systemtic Name: 5-azanyl-2-[[4-[(E)-3-imidazol-1-yl-2-(1,3-thiazol-2-yl)prop-1-enyl]-2-phenyl-phenyl]carbonylamino]-5-oxidanylidene-pentanoate Openeye Name: 5-amino-2-[[4-[(E)-3-imidazol-1-yl-2-thiazol-2-yl-prop-1-enyl]-2-phenyl-benzoyl]amino]-5-oxo-pentanoate CAS Name: 5-amino-2-[[[4-[(E)-3-(1-imidazolyl)-2-(2-thiazolyl)prop-1-enyl]-2-phenylphenyl]-oxomethyl]amino]-5-oxopentanoate IUPAC Name: 5-amino-2-[[4-[(E)-3-imidazol-1-yl-2-(1,3-thiazol-2-yl)prop-1-enyl]-2-phenylbenzoyl]amino]-5-oxopentanoate Traditional Name: 5-amino-2-[[4-[(E)-3-imidazol-1-yl-2-thiazol-2-yl-prop-1-enyl]-2-phenyl-benzoyl]amino]-5-keto-valerate Formula: C27H24N5O4S- MolecularWeight: 514.57556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=CC(=C2)C=C(CN3C=CN=C3)C4=NC=CS4)C(=O)NC(CCC(=O)N)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=CC(=C2)/C=C(\CN3C=CN=C3)/C4=NC=CS4)C(=O)NC(CCC(=O)N)C(=O)[O-]

InChI

InChI=1S/C27H25N5O4S/c28-24(33)9-8-23(27(35)36)31-25(34)21-7-6-18(15-22(21)19-4-2-1-3-5-19)14-20(26-30-11-13-37-26)16-32-12-10-29-17-32/h1-7,10-15,17,23H,8-9,16H2,(H2,28,33)(H,31,34)(H,35,36)/p-1/b20-14+