8-methoxy-4-[(3S)-4-(4-methoxyphenyl)-3-methyl-piperazin-1-yl]-5-methyl-pyrimido[5,4-b]indole

Systemtic Name: 8-methoxy-4-[(3S)-4-(4-methoxyphenyl)-3-methyl-piperazin-1-yl]-5-methyl-pyrimido[5,4-b]indole Openeye Name: 8-methoxy-4-[(3S)-4-(4-methoxyphenyl)-3-methyl-piperazin-1-yl]-5-methyl-pyrimido[5,4-b]indole CAS Name: 8-methoxy-4-[(3S)-4-(4-methoxyphenyl)-3-methyl-1-piperazinyl]-5-methylpyrimido[5,4-b]indole IUPAC Name: 8-methoxy-4-[(3S)-4-(4-methoxyphenyl)-3-methylpiperazin-1-yl]-5-methylpyrimido[5,4-b]indole Traditional Name: 8-methoxy-4-[(3S)-4-(4-methoxyphenyl)-3-methyl-piperazino]-5-methyl-pyrimid[5,4-b]indole Formula: C24H27N5O2 MolecularWeight: 417.50348

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)OC)C3=NC=NC4=C3N(C5=C4C=C(C=C5)OC)C

Isomeric SMILES

C[C@H]1CN(CCN1C2=CC=C(C=C2)OC)C3=NC=NC4=C3N(C5=C4C=C(C=C5)OC)C

InChI

InChI=1S/C24H27N5O2/c1-16-14-28(11-12-29(16)17-5-7-18(30-3)8-6-17)24-23-22(25-15-26-24)20-13-19(31-4)9-10-21(20)27(23)2/h5-10,13,15-16H,11-12,14H2,1-4H3/t16-/m0/s1