4-azanyl-9-[(4-methoxyphenyl)methyl]-N-(phenylmethyl)pyrimido[4,5-b]indole-2-carboxamide

Systemtic Name: 4-azanyl-9-[(4-methoxyphenyl)methyl]-N-(phenylmethyl)pyrimido[4,5-b]indole-2-carboxamide Openeye Name: 4-amino-N-benzyl-9-[(4-methoxyphenyl)methyl]pyrimido[4,5-b]indole-2-carboxamide CAS Name: 4-amino-9-[(4-methoxyphenyl)methyl]-N-(phenylmethyl)-2-pyrimido[4,5-b]indolecarboxamide IUPAC Name: 4-amino-N-benzyl-9-[(4-methoxyphenyl)methyl]pyrimido[4,5-b]indole-2-carboxamide Traditional Name: 4-amino-N-benzyl-9-p-anisyl-pyrimid[4,5-b]indole-2-carboxamide Formula: C26H23N5O2 MolecularWeight: 437.49312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C3=CC=CC=C3C4=C2N=C(N=C4N)C(=O)NCC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)CN2C3=CC=CC=C3C4=C2N=C(N=C4N)C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C26H23N5O2/c1-33-19-13-11-18(12-14-19)16-31-21-10-6-5-9-20(21)22-23(27)29-24(30-25(22)31)26(32)28-15-17-7-3-2-4-8-17/h2-14H,15-16H2,1H3,(H,28,32)(H2,27,29,30)