9H-fluoren-9-ylmethyl N-[(2R)-1-[(2-azanyl-5-nitro-phenyl)amino]-3-phenyl-1-sulfanylidene-propan-2-yl]carbamate

Systemtic Name: 9H-fluoren-9-ylmethyl N-[(2R)-1-[(2-azanyl-5-nitro-phenyl)amino]-3-phenyl-1-sulfanylidene-propan-2-yl]carbamate Openeye Name: 9H-fluoren-9-ylmethyl N-[(1R)-2-(2-amino-5-nitro-anilino)-1-benzyl-2-thioxo-ethyl]carbamate CAS Name: N-[(2R)-1-(2-amino-5-nitroanilino)-3-phenyl-1-sulfanylidenepropan-2-yl]carbamic acid 9H-fluoren-9-ylmethyl ester IUPAC Name: 9H-fluoren-9-ylmethyl N-[(2R)-1-(2-amino-5-nitroanilino)-3-phenyl-1-sulfanylidenepropan-2-yl]carbamate Traditional Name: N-[(1R)-2-(2-amino-5-nitro-anilino)-1-benzyl-2-thioxo-ethyl]carbamic acid 9H-fluoren-9-ylmethyl ester Formula: C30H26N4O4S MolecularWeight: 538.61684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])N)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])N)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C30H26N4O4S/c31-26-15-14-20(34(36)37)17-27(26)32-29(39)28(16-19-8-2-1-3-9-19)33-30(35)38-18-25-23-12-6-4-10-21(23)22-11-5-7-13-24(22)25/h1-15,17,25,28H,16,18,31H2,(H,32,39)(H,33,35)/t28-/m1/s1