ethyl N-[3-(cyclohexylamino)-2-methyl-6-[(3-nitro-5-propanoyl-thiophen-2-yl)diazenyl]phenyl]carbamate

Systemtic Name: ethyl N-[3-(cyclohexylamino)-2-methyl-6-[(3-nitro-5-propanoyl-thiophen-2-yl)diazenyl]phenyl]carbamate Openeye Name: ethyl N-[3-(cyclohexylamino)-2-methyl-6-[(3-nitro-5-propanoyl-2-thienyl)azo]phenyl]carbamate CAS Name: N-[3-(cyclohexylamino)-2-methyl-6-[[3-nitro-5-(1-oxopropyl)-2-thiophenyl]azo]phenyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[3-(cyclohexylamino)-2-methyl-6-[(3-nitro-5-propanoylthiophen-2-yl)diazenyl]phenyl]carbamate Traditional Name: N-[3-(cyclohexylamino)-2-methyl-6-[(3-nitro-5-propionyl-2-thienyl)azo]phenyl]carbamic acid ethyl ester Formula: C23H29N5O5S MolecularWeight: 487.57186

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=C(S1)N=NC2=C(C(=C(C=C2)NC3CCCCC3)C)NC(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)C1=CC(=C(S1)N=NC2=C(C(=C(C=C2)NC3CCCCC3)C)NC(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C23H29N5O5S/c1-4-19(29)20-13-18(28(31)32)22(34-20)27-26-17-12-11-16(24-15-9-7-6-8-10-15)14(3)21(17)25-23(30)33-5-2/h11-13,15,24H,4-10H2,1-3H3,(H,25,30)