4-(5-methoxypyrimidin-4-yl)-1,2-dimethyl-5-piperazin-1-yl-3-propyl-indole

Systemtic Name: 4-(5-methoxypyrimidin-4-yl)-1,2-dimethyl-5-piperazin-1-yl-3-propyl-indole Openeye Name: 4-(5-methoxypyrimidin-4-yl)-1,2-dimethyl-5-piperazin-1-yl-3-propyl-indole CAS Name: 4-(5-methoxy-4-pyrimidinyl)-1,2-dimethyl-5-(1-piperazinyl)-3-propylindole IUPAC Name: 4-(5-methoxypyrimidin-4-yl)-1,2-dimethyl-5-piperazin-1-yl-3-propylindole Traditional Name: 4-(5-methoxypyrimidin-4-yl)-1,2-dimethyl-5-piperazino-3-propyl-indole Formula: C22H29N5O MolecularWeight: 379.49856

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N(C2=C1C(=C(C=C2)N3CCNCC3)C4=NC=NC=C4OC)C)C

Isomeric SMILES

CCCC1=C(N(C2=C1C(=C(C=C2)N3CCNCC3)C4=NC=NC=C4OC)C)C

InChI

InChI=1S/C22H29N5O/c1-5-6-16-15(2)26(3)17-7-8-18(27-11-9-23-10-12-27)21(20(16)17)22-19(28-4)13-24-14-25-22/h7-8,13-14,23H,5-6,9-12H2,1-4H3