1-(4-aminophenyl)-5-cyclohexyl-3-(2-methoxyethyl)-8-methyl-1,3,4-benzotriazepin-2-one

Systemtic Name: 1-(4-aminophenyl)-5-cyclohexyl-3-(2-methoxyethyl)-8-methyl-1,3,4-benzotriazepin-2-one Openeye Name: 1-(4-aminophenyl)-5-cyclohexyl-3-(2-methoxyethyl)-8-methyl-1,3,4-benzotriazepin-2-one CAS Name: 1-(4-aminophenyl)-5-cyclohexyl-3-(2-methoxyethyl)-8-methyl-1,3,4-benzotriazepin-2-one IUPAC Name: 1-(4-aminophenyl)-5-cyclohexyl-3-(2-methoxyethyl)-8-methyl-1,3,4-benzotriazepin-2-one Traditional Name: 1-(4-aminophenyl)-5-cyclohexyl-3-(2-methoxyethyl)-8-methyl-1,3,4-benzotriazepin-2-one Formula: C24H30N4O2 MolecularWeight: 406.5206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NN(C(=O)N2C3=CC=C(C=C3)N)CCOC)C4CCCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NN(C(=O)N2C3=CC=C(C=C3)N)CCOC)C4CCCCC4

InChI

InChI=1S/C24H30N4O2/c1-17-8-13-21-22(16-17)28(20-11-9-19(25)10-12-20)24(29)27(14-15-30-2)26-23(21)18-6-4-3-5-7-18/h8-13,16,18H,3-7,14-15,25H2,1-2H3