ethyl 2-[2-[3-(1H-indol-2-ylcarbonylamino)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl]ethanoylamino]ethanoate

Systemtic Name: ethyl 2-[2-[3-(1H-indol-2-ylcarbonylamino)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl]ethanoylamino]ethanoate Openeye Name: ethyl 2-[[2-[3-(1H-indole-2-carbonylamino)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetyl]amino]acetate CAS Name: 2-[[2-[3-[[1H-indol-2-yl(oxo)methyl]amino]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]-1-oxoethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[3-(1H-indole-2-carbonylamino)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetyl]amino]acetate Traditional Name: 2-[[2-[3-(1H-indole-2-carbonylamino)-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetyl]amino]acetic acid ethyl ester Formula: C30H27N5O5 MolecularWeight: 537.56588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)C3=CC4=CC=CC=C4N3)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)CNC(=O)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)C3=CC4=CC=CC=C4N3)C5=CC=CC=C5

InChI

InChI=1S/C30H27N5O5/c1-2-40-26(37)17-31-25(36)18-35-24-15-9-7-13-21(24)27(19-10-4-3-5-11-19)33-28(30(35)39)34-29(38)23-16-20-12-6-8-14-22(20)32-23/h3-16,28,32H,2,17-18H2,1H3,(H,31,36)(H,34,38)